A0A3B3VSN6_9TELE Loading...

Pdgfa associated protein 1b

AlphaFold DB , UniProt , Accession A0A3B3VSN6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 182 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.1	Low	60.2	Low	233 Å²	233	149.1 Å²	149.1	100%	1.148	84%	0.837	S	S	*	*				0	112.6	0	-72.6	171.8	156.1	0	0	108.8
2	P	59.4	Low	60.6	Low	132 Å²	132	142.9 Å²	142.9	86%	0.857	83%	0.832	S	S	*	*			trans	-77.8	124.7	177.6	30.4	-29.2	0	0	0	109.6	G4	P2-G4 PolarHBondContact O-N 3.44Å; P2-G4 VanDerWaalsContact O-N 3.15Å
3	K	59.1	Low	61.8	Low	211 Å²	211	146.3 Å²	146.3	92%	0.917	82%	0.822	S	S	*	*			trans	-70.1	108.6	174.8	-72.1	-163.5	176.1	180	0	108.6	G5	K3-G5 PolarHBondContact O-N 2.99Å; K3-G5 VanDerWaalsContact O-N 3.07Å
4	G	54.9	Low	62.5	Low	79 Å²	79	147.8 Å²	147.8	81%	0.814	82%	0.822	S	S	*	*			trans	-56	111.4	175.4	0	0	0	0	0	110.8	P2 K6	P2-G4 PolarHBondContact O-N 3.44Å; P2-G4 VanDerWaalsContact O-N 3.15Å; G4-K6 PolarHBondContact O-N 3.32Å
5	G	63.1	Low	63.5	Low	71 Å²	71	152 Å²	152	73%	0.732	82%	0.82	S	S	*	*			trans	-59.8	121	171.2	0	0	0	0	0	109.3	K3 K7	K3-G5 PolarHBondContact O-N 2.99Å; K3-G5 VanDerWaalsContact O-N 3.07Å; G5-K7 PolarHBondContact O-N 3.05Å
6	K	61.1	Low	64.4	Low	206 Å²	206	149.1 Å²	149.1	90%	0.896	81%	0.81	S	S	*	*			trans	-62.5	102.3	178.5	-163.9	158.1	-179.8	174.8	0	108	G4 G8	G4-K6 PolarHBondContact O-N 3.32Å; K6-G8 PolarHBondContact O-N 2.92Å
7	K	64.8	Low	65.3	Low	211 Å²	211	152.1 Å²	152.1	92%	0.917	81%	0.808	S	S	*	*			trans	-62.6	84.6	166.4	-84.5	-175.6	176.1	178.1	0	107.6	G5 G9	G5-K7 PolarHBondContact O-N 3.05Å; K7-G9 PolarHBondContact O-N 3.23Å
8	G	60.4	Low	66.4	Low	60 Å²	60	147.7 Å²	147.7	62%	0.619	79%	0.788	S	S	*	*			trans	-59.1	118	172.7	0	0	0	0	0	108.1	K6 H10	K6-G8 PolarHBondContact O-N 2.92Å; G8-H10 PolarHBondContact O-N 2.97Å
9	G	59.6	Low	67.4	Low	60 Å²	60	142.3 Å²	142.3	62%	0.619	76%	0.763	S	S	*	*			trans	-57.2	137	-176.2	0	0	0	0	0	110.9	K7 K11	K7-G9 PolarHBondContact O-N 3.23Å; G9-K11 PolarHBondContact O-N 3.46Å
10	H	64.4	Low	68.1	Low	172 Å²	172	140 Å²	140	80%	0.796	76%	0.756	S	S	*	*	S	Bend	trans	-65.9	20.2	168.6	-61.1	-63.1	0	0	0	113.2	G8 G12	G8-H10 PolarHBondContact O-N 2.97Å; H10-G12 PolarHBondContact O-N 2.96Å
11	K	62.1	Low	68.8	Low	205 Å²	205	141 Å²	141	89%	0.891	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	96.2	176.7	-60.7	-174.3	-178.1	-175.9	0	106.9	G9	G9-K11 PolarHBondContact O-N 3.46Å
12	G	65.6	Low	70.2	Confident	75 Å²	75	134.8 Å²	134.8	77%	0.773	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	124	-2.6	177.7	0	0	0	0	0	115.5	H10 M14	H10-G12 PolarHBondContact O-N 2.96Å; G12-M14 PolarHBondContact O-N 2.82Å
13	R	75.6	Confident	71.4	Confident	187 Å²	187	132.1 Å²	132.1	71%	0.706	70%	0.702	S	S	*	*			trans	-70.9	116.9	164.7	-172.4	170.7	177.3	-107.7	-0.5	107.2	R15	R13-R15 PolarHBondContact O-N 3.36Å
14	M	72.6	Confident	72.7	Confident	167 Å²	167	127.3 Å²	127.3	82%	0.823	69%	0.686	S	S	*	*			trans	-51.1	132.9	175	-73.9	-157.7	79.7	0	0	109.2	G12 T16	G12-M14 PolarHBondContact O-N 2.82Å; M14-T16 PolarHBondContact O-N 3.13Å
15	R	76.4	Confident	74.3	Confident	211 Å²	211	126.4 Å²	126.4	80%	0.796	67%	0.671	S	S	*	*			trans	-65.6	103.8	173.5	-63.2	173.3	78.6	116.3	-1.8	106.4	R13 Y17	R13-R15 PolarHBondContact O-N 3.36Å; R15-Y17 PolarHBondContact O-N 3.15Å
16	T	78.3	Confident	75.5	Confident	106 Å²	106	128.9 Å²	128.9	65%	0.65	66%	0.664	S	S	*	*			trans	-75.9	113.2	170	51.2	0	0	0	0	106.6	M14	M14-T16 PolarHBondContact O-N 3.13Å
17	Y	80	Confident	76.8	Confident	199 Å²	199	124.6 Å²	124.6	78%	0.78	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-72.7	127.4	167.2	-64.2	-78.8	0	0	0	107.4	R15 S19	R15-Y17 PolarHBondContact O-N 3.15Å; Y17-S19 PolarHBondContact O-N 2.78Å
18	T	84.3	Confident	78	Confident	73 Å²	73	120.9 Å²	120.9	45%	0.448	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-56.5	135	169.4	-7.4	0	0	0	0	108.1	E22	T18-E22 HydrophobicContact CG2-CB 3.94Å
19	S	85.4	Confident	79.4	Confident	46 Å²	46	120 Å²	120	32%	0.322	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-65.8	149.1	176.9	64.2	0	0	0	0	109.8	Y17 E21 E22 I23	Y17-S19 PolarHBondContact O-N 2.78Å; S19-E21 PolarHBondContact O-N 3.45Å; S19-E22 PolarHBondContact N-OE2 3.39Å; S19-E22 WeakPolarHBondContact O-CB 3.2Å; S19-E22 PolarHBondContact O-N 3.1Å; S19-E22 WeakPolarHBondContact OG-CB 3.34Å; S19-E22 WeakPolarHBondContact OG-CG 3.03Å; S19-E22 PolarHBondContact OG-N 3.2Å; S19-E22 PolarHBondContact OG-OE2 3.36Å; S19-I23 PolarHBondContact O-N 3.13Å; S19-I23 VanDerWaalsContact O-N 3.11Å
20	P	82.1	Confident	80.8	Confident	95 Å²	95	123.3 Å²	123.3	62%	0.617	62%	0.618	S	S	*	*	H	α-helix	trans	-58.2	-33.1	179.5	20.5	-31	0	0	0	112.4	E22 I23 D24	P20-E22 VanDerWaalsContact C-N 3.35Å; P20-E22 PolarHBondContact O-N 3.46Å; P20-I23 PolarHBondContact O-N 3.25Å; P20-D24 PolarHBondContact O-N 3.13Å
21	E	81.9	Confident	82	Confident	162 Å²	162	121.8 Å²	121.8	76%	0.757	61%	0.61	S	S	*	*	H	α-helix	trans	-66.1	-35.1	174.8	-66.6	-174.2	170.1	0	0	112.7	S19 A25	S19-E21 PolarHBondContact O-N 3.45Å; E21-A25 VanDerWaalsContact O-CB 3.28Å; E21-A25 WeakPolarHBondContact O-CB 3.21Å; E21-A25 PolarHBondContact O-N 3.1Å
22	E	82.8	Confident	83.3	Confident	102 Å²	102	117.3 Å²	117.3	48%	0.477	59%	0.592	S	S	.	*	H	α-helix	trans	-70.2	-36	174.8	-76.2	165.8	150.5	0	0	112	T18 S19 P20 A25 Q26	T18-E22 HydrophobicContact CG2-CB 3.94Å; S19-E22 PolarHBondContact N-OE2 3.39Å; S19-E22 WeakPolarHBondContact O-CB 3.2Å; S19-E22 PolarHBondContact O-N 3.1Å; S19-E22 WeakPolarHBondContact OG-CB 3.34Å; S19-E22 WeakPolarHBondContact OG-CG 3.03Å; S19-E22 PolarHBondContact OG-N 3.2Å; S19-E22 PolarHBondContact OG-OE2 3.36Å; P20-E22 VanDerWaalsContact C-N 3.35Å; P20-E22 PolarHBondContact O-N 3.46Å; E22-A25 PolarHBondContact O-N 3.26Å; E22-Q26 WeakPolarHBondContact O-CB 3.46Å; E22-Q26 VanDerWaalsContact O-CG 3.23Å; E22-Q26 WeakPolarHBondContact O-CG 3.47Å; E22-Q26 PolarHBondContact O-N 2.8Å
23	I	84.6	Confident	84.3	Confident	77 Å²	77	122.8 Å²	122.8	40%	0.395	59%	0.589	S	S	.	*	H	α-helix	trans	-65.5	-46.5	175.5	-61.4	170.4	0	0	0	109.5	S19 P20 A25 Q26 M27	S19-I23 PolarHBondContact O-N 3.13Å; S19-I23 VanDerWaalsContact O-N 3.11Å; P20-I23 PolarHBondContact O-N 3.25Å; I23-A25 VanDerWaalsContact C-N 3.35Å; I23-A25 PolarHBondContact O-N 3.04Å; I23-Q26 PolarHBondContact O-N 3.37Å; I23-M27 HydrophobicContact CG2-CG 4.44Å; I23-M27 VanDerWaalsContact O-CG 3.28Å; I23-M27 WeakPolarHBondContact O-CG 3.23Å; I23-M27 PolarHBondContact O-N 3.29Å
24	D	87.4	Confident	84.9	Confident	110 Å²	110	120.1 Å²	120.1	59%	0.588	58%	0.583	S	S	*	*	H	α-helix	trans	-63.3	-40.7	178	-71.3	-17.3	0	0	0	111.9	P20 M27 K28	P20-D24 PolarHBondContact O-N 3.13Å; D24-M27 PolarHBondContact O-N 2.91Å; D24-K28 VanDerWaalsContact O-CB 3.3Å; D24-K28 WeakPolarHBondContact O-CB 3.15Å; D24-K28 PolarHBondContact O-N 2.98Å
25	A	88.2	Confident	85.5	Confident	60 Å²	60	117.5 Å²	117.5	50%	0.496	57%	0.567	S	S	.	*	H	α-helix	trans	-64.4	-40.4	176	0	0	0	0	0	112.1	E21 E22 I23 K28 A29	E21-A25 VanDerWaalsContact O-CB 3.28Å; E21-A25 WeakPolarHBondContact O-CB 3.21Å; E21-A25 PolarHBondContact O-N 3.1Å; E22-A25 PolarHBondContact O-N 3.26Å; I23-A25 VanDerWaalsContact C-N 3.35Å; I23-A25 PolarHBondContact O-N 3.04Å; A25-K28 PolarHBondContact O-N 3.16Å; A25-A29 WeakPolarHBondContact O-CB 3.17Å; A25-A29 PolarHBondContact O-N 2.94Å
26	Q	87.9	Confident	85.7	Confident	123 Å²	123	112.5 Å²	112.5	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-64.7	-47.5	175.5	-76.5	175.6	6.4	0	0	111.5	E22 I23 K28 A29 E30	E22-Q26 WeakPolarHBondContact O-CB 3.46Å; E22-Q26 VanDerWaalsContact O-CG 3.23Å; E22-Q26 WeakPolarHBondContact O-CG 3.47Å; E22-Q26 PolarHBondContact O-N 2.8Å; I23-Q26 PolarHBondContact O-N 3.37Å; Q26-K28 VanDerWaalsContact C-N 3.28Å; Q26-K28 PolarHBondContact O-N 2.92Å; Q26-A29 PolarHBondContact O-N 2.76Å; Q26-E30 WeakPolarHBondContact O-CB 3.19Å; Q26-E30 PolarHBondContact O-N 3.32Å
27	M	88.9	Confident	85.7	Confident	116 Å²	116	113.2 Å²	113.2	57%	0.571	55%	0.548	S	S	*	.	H	α-helix	trans	-60.8	-38.7	177.1	-70.4	-62.9	-65.8	0	0	111.9	I23 D24 K31	I23-M27 HydrophobicContact CG2-CG 4.44Å; I23-M27 VanDerWaalsContact O-CG 3.28Å; I23-M27 WeakPolarHBondContact O-CG 3.23Å; I23-M27 PolarHBondContact O-N 3.29Å; D24-M27 PolarHBondContact O-N 2.91Å; M27-K31 WeakPolarHBondContact O-CB 3.43Å; M27-K31 PolarHBondContact O-N 3.24Å
28	K	89.4	Confident	85.4	Confident	132 Å²	132	109.7 Å²	109.7	57%	0.574	54%	0.539	S	S	*	.	H	α-helix	trans	-68.3	-44.4	177.1	-169.2	179.7	178.5	-170.1	0	111.7	D24 A25 Q26 E30 K31 E32	D24-K28 VanDerWaalsContact O-CB 3.3Å; D24-K28 WeakPolarHBondContact O-CB 3.15Å; D24-K28 PolarHBondContact O-N 2.98Å; A25-K28 PolarHBondContact O-N 3.16Å; Q26-K28 VanDerWaalsContact C-N 3.28Å; Q26-K28 PolarHBondContact O-N 2.92Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 2.79Å; K28-K31 PolarHBondContact O-N 2.82Å; K28-E32 VanDerWaalsContact CE-OE1 3.27Å; K28-E32 WeakPolarHBondContact CE-OE1 3.35Å; K28-E32 WeakPolarHBondContact O-CG 3.42Å; K28-E32 PolarHBondContact O-N 3.22Å
29	A	90.2	Very high	84.7	Confident	42 Å²	42	112.9 Å²	112.9	35%	0.347	55%	0.549	S	S	.	.	H	α-helix	trans	-63.3	-39.3	177.3	0	0	0	0	0	112	A25 Q26 E32 R33	A25-A29 WeakPolarHBondContact O-CB 3.17Å; A25-A29 PolarHBondContact O-N 2.94Å; Q26-A29 PolarHBondContact O-N 2.76Å; A29-E32 PolarHBondContact O-N 3.18Å; A29-R33 VanDerWaalsContact O-CG 3.32Å; A29-R33 WeakPolarHBondContact O-CG 3.45Å; A29-R33 PolarHBondContact O-N 2.77Å
30	E	89.5	Confident	83.6	Confident	129 Å²	129	117 Å²	117	60%	0.603	56%	0.563	S	S	*	*	H	α-helix	trans	-67	-40.6	176.1	-167.3	176.1	-172.4	0	0	111.6	Q26 K28 E32 R33 K34	Q26-E30 WeakPolarHBondContact O-CB 3.19Å; Q26-E30 PolarHBondContact O-N 3.32Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 2.79Å; E30-E32 PolarHBondContact O-N 3.16Å; E30-R33 PolarHBondContact O-N 2.73Å; E30-K34 WeakPolarHBondContact O-CB 3.49Å; E30-K34 PolarHBondContact O-N 2.96Å
31	K	90	Very high	82.4	Confident	141 Å²	141	119.5 Å²	119.5	61%	0.613	57%	0.566	S	S	*	*	H	α-helix	trans	-64.9	-38.3	174.6	-169.5	174.2	-174	173.1	0	112.5	M27 K28 K35	M27-K31 WeakPolarHBondContact O-CB 3.43Å; M27-K31 PolarHBondContact O-N 3.24Å; K28-K31 PolarHBondContact O-N 2.82Å; K31-K35 WeakPolarHBondContact O-CB 3.5Å; K31-K35 VanDerWaalsContact O-CG 3.29Å; K31-K35 WeakPolarHBondContact O-CG 3.25Å; K31-K35 PolarHBondContact O-N 2.89Å
32	E	87.7	Confident	80.8	Confident	110 Å²	110	114.8 Å²	114.8	51%	0.514	56%	0.561	S	S	.	*	H	α-helix	trans	-68.3	-41.3	175.4	-76.1	175.8	-175.6	0	0	111.5	K28 A29 E30 K35 H36	K28-E32 VanDerWaalsContact CE-OE1 3.27Å; K28-E32 WeakPolarHBondContact CE-OE1 3.35Å; K28-E32 WeakPolarHBondContact O-CG 3.42Å; K28-E32 PolarHBondContact O-N 3.22Å; A29-E32 PolarHBondContact O-N 3.18Å; E30-E32 PolarHBondContact O-N 3.16Å; E32-K35 PolarHBondContact O-N 3.27Å; E32-H36 WeakPolarHBondContact O-CB 3.45Å; E32-H36 PolarHBondContact O-N 3.03Å
33	R	87.5	Confident	79.2	Confident	190 Å²	190	118.4 Å²	118.4	72%	0.717	58%	0.578	S	S	*	*	H	α-helix	trans	-61.2	-47.4	173.2	-75.4	176	-179.9	-169.8	-0.7	112.1	A29 E30 K35 H36 E37	A29-R33 VanDerWaalsContact O-CG 3.32Å; A29-R33 WeakPolarHBondContact O-CG 3.45Å; A29-R33 PolarHBondContact O-N 2.77Å; E30-R33 PolarHBondContact O-N 2.73Å; R33-K35 VanDerWaalsContact C-N 3.28Å; R33-K35 PolarHBondContact O-N 3.41Å; R33-H36 PolarHBondContact O-N 3.05Å; R33-E37 WeakPolarHBondContact O-CB 3.34Å; R33-E37 PolarHBondContact O-N 2.96Å
34	K	87.5	Confident	77.1	Confident	132 Å²	132	123.6 Å²	123.6	57%	0.574	60%	0.601	S	S	*	*	H	α-helix	trans	-63.5	-34.9	178.4	-171.6	172.8	-176	172.1	0	112.4	E30 Q38	E30-K34 WeakPolarHBondContact O-CB 3.49Å; E30-K34 PolarHBondContact O-N 2.96Å; K34-Q38 WeakPolarHBondContact O-CB 3.45Å; K34-Q38 WeakPolarHBondContact O-CG 3.26Å; K34-Q38 PolarHBondContact O-N 3.07Å
35	K	86.3	Confident	74.5	Confident	112 Å²	112	121.6 Å²	121.6	49%	0.487	61%	0.606	S	S	.	*	H	α-helix	trans	-67.2	-44.9	172.7	-81	-178.8	171.6	-158.2	0	111.9	K31 E32 R33 E37 Q38 E39	K31-K35 WeakPolarHBondContact O-CB 3.5Å; K31-K35 VanDerWaalsContact O-CG 3.29Å; K31-K35 WeakPolarHBondContact O-CG 3.25Å; K31-K35 PolarHBondContact O-N 2.89Å; E32-K35 PolarHBondContact O-N 3.27Å; R33-K35 VanDerWaalsContact C-N 3.28Å; R33-K35 PolarHBondContact O-N 3.41Å; K35-E37 VanDerWaalsContact C-N 3.3Å; K35-E37 PolarHBondContact O-N 3.49Å; K35-Q38 CarbonylContact O-C 3.59Å; K35-Q38 PolarHBondContact O-N 3.06Å; K35-E39 WeakPolarHBondContact O-CB 3.38Å; K35-E39 WeakPolarHBondContact O-CG 3.38Å; K35-E39 PolarHBondContact O-N 3.27Å
36	H	79.6	Confident	72.3	Confident	106 Å²	106	123.8 Å²	123.8	49%	0.491	62%	0.624	S	S	.	*	H	α-helix	trans	-62.5	-40.5	177.1	-167.7	-82	0	0	0	111.4	E32 R33 E39 E40	E32-H36 WeakPolarHBondContact O-CB 3.45Å; E32-H36 PolarHBondContact O-N 3.03Å; R33-H36 PolarHBondContact O-N 3.05Å; H36-E39 PolarHBondContact O-N 2.98Å; H36-E40 IonicContact CE1-OE1 3.85Å; H36-E40 PolarHBondContact CE1-OE1 3.28Å; H36-E40 IonicContact CE1-OE2 3.56Å; H36-E40 IonicContact ND1-OE1 3.32Å; H36-E40 IonicContact ND1-OE2 3.22Å; H36-E40 WeakPolarHBondContact O-CB 3.46Å; H36-E40 WeakPolarHBondContact O-CG 3.45Å; H36-E40 PolarHBondContact O-N 3.39Å
37	E	79.3	Confident	69.6	Low	121 Å²	121	123.2 Å²	123.2	57%	0.565	63%	0.633	S	S	*	*	H	α-helix	trans	-65.8	-38.5	175.1	-166.6	171.8	-163.1	0	0	111.6	R33 K35 E41	R33-E37 WeakPolarHBondContact O-CB 3.34Å; R33-E37 PolarHBondContact O-N 2.96Å; K35-E37 VanDerWaalsContact C-N 3.3Å; K35-E37 PolarHBondContact O-N 3.49Å; E37-E41 VanDerWaalsContact O-CB 3.31Å; E37-E41 WeakPolarHBondContact O-CB 3.42Å; E37-E41 WeakPolarHBondContact O-CG 3.31Å; E37-E41 PolarHBondContact O-N 3.5Å
38	Q	72.3	Confident	67.8	Low	124 Å²	124	123.8 Å²	123.8	58%	0.579	65%	0.646	S	S	*	*	H	α-helix	trans	-69.6	-32	171.9	-79.7	-179	-5	0	0	113.9	K34 K35 G42	K34-Q38 WeakPolarHBondContact O-CB 3.45Å; K34-Q38 WeakPolarHBondContact O-CG 3.26Å; K34-Q38 PolarHBondContact O-N 3.07Å; K35-Q38 CarbonylContact O-C 3.59Å; K35-Q38 PolarHBondContact O-N 3.06Å; Q38-G42 WeakPolarHBondContact O-CA 3.35Å; Q38-G42 PolarHBondContact O-N 3.44Å
39	E	70.6	Confident	65.3	Low	141 Å²	141	127.4 Å²	127.4	66%	0.659	66%	0.661	S	S	*	*	H	α-helix	trans	-74.8	-37.7	175.8	-76.3	173.6	-170.2	0	0	110.9	K35 H36 G42	K35-E39 WeakPolarHBondContact O-CB 3.38Å; K35-E39 WeakPolarHBondContact O-CG 3.38Å; K35-E39 PolarHBondContact O-N 3.27Å; H36-E39 PolarHBondContact O-N 2.98Å; E39-G42 PolarHBondContact O-N 2.87Å
40	E	62.5	Low	62.9	Low	133 Å²	133	132.3 Å²	132.3	62%	0.621	68%	0.682	S	S	*	*	H	α-helix	trans	-72	-39.7	173.2	-75.6	-168	150.2	0	0	112.6	H36 G42	H36-E40 IonicContact CE1-OE1 3.85Å; H36-E40 PolarHBondContact CE1-OE1 3.28Å; H36-E40 IonicContact CE1-OE2 3.56Å; H36-E40 IonicContact ND1-OE1 3.32Å; H36-E40 IonicContact ND1-OE2 3.22Å; H36-E40 WeakPolarHBondContact O-CB 3.46Å; H36-E40 WeakPolarHBondContact O-CG 3.45Å; H36-E40 PolarHBondContact O-N 3.39Å; E40-G42 VanDerWaalsContact C-N 3.25Å; E40-G42 PolarHBondContact O-N 3.36Å
41	E	56.1	Low	60.5	Low	146 Å²	146	133 Å²	133	68%	0.682	70%	0.695	S	S	*	*	H	α-helix	trans	-73.9	-15.9	172.4	-73.4	-161.4	157.7	0	0	113	E37 E43	E37-E41 VanDerWaalsContact O-CB 3.31Å; E37-E41 WeakPolarHBondContact O-CB 3.42Å; E37-E41 WeakPolarHBondContact O-CG 3.31Å; E37-E41 PolarHBondContact O-N 3.5Å; E41-E43 VanDerWaalsContact C-N 3.32Å; E41-E43 PolarHBondContact O-N 2.9Å
42	G	49.4	Very low	58	Low	63 Å²	63	130.8 Å²	130.8	65%	0.649	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-12.9	177.4	0	0	0	0	0	114.9	Q38 E39 E40	Q38-G42 WeakPolarHBondContact O-CA 3.35Å; Q38-G42 PolarHBondContact O-N 3.44Å; E39-G42 PolarHBondContact O-N 2.87Å; E40-G42 VanDerWaalsContact C-N 3.25Å; E40-G42 PolarHBondContact O-N 3.36Å
43	E	47.6	Very low	55.8	Low	179 Å²	179	135 Å²	135	84%	0.836	72%	0.723	S	S	*	*	S	Bend	trans	-92.1	-15.9	179.1	-146.3	177.2	-176.2	0	0	113.2	E41	E41-E43 VanDerWaalsContact C-N 3.32Å; E41-E43 PolarHBondContact O-N 2.9Å
44	E	40.5	Very low	53.6	Low	186 Å²	186	134.9 Å²	134.9	87%	0.869	73%	0.73	S	S	*	*	S	Bend	trans	-127.4	84.1	172.8	-75.1	-160.6	161.7	0	0	112.5
45	G	32.7	Very low	51.4	Low	68 Å²	68	137.9 Å²	137.9	70%	0.701	74%	0.744	S	S	*	*			trans	119	95.7	153.5	0	0	0	0	0	116.4	S47	G45-S47 PolarHBondContact O-N 3.43Å
46	A	42.6	Very low	49.4	Very low	105 Å²	105	140.2 Å²	140.2	87%	0.868	76%	0.76	S	S	*	*			trans	-61.4	120.2	165.3	0	0	0	0	0	112
47	S	32.4	Very low	47.8	Very low	111 Å²	111	141 Å²	141	78%	0.776	78%	0.775	S	S	*	*			trans	-159.9	131.2	155.5	-73.9	0	0	0	0	110.3	G45	G45-S47 PolarHBondContact O-N 3.43Å
48	P	49.9	Very low	46	Very low	128 Å²	128	139 Å²	139	83%	0.831	79%	0.786	S	S	*	*			trans	-84.4	129.5	178.9	33.6	-29.2	0	0	0	109.6
49	K	36.3	Very low	44.5	Very low	208 Å²	208	138.3 Å²	138.3	90%	0.904	80%	0.796	S	S	*	*			trans	-136.8	111.6	166.3	-94.7	-175.5	178.6	174.6	0	111.3
50	D	39.6	Very low	43.2	Very low	146 Å²	146	138.5 Å²	138.5	78%	0.781	80%	0.801	S	S	*	*			trans	-50.5	164.6	157.3	-69.7	-61.8	0	0	0	112.7
51	T	39.8	Very low	42.2	Very low	142 Å²	142	136.5 Å²	136.5	87%	0.871	80%	0.802	S	S	*	*			trans	86.7	104.1	161.7	70.2	0	0	0	0	117.8
52	A	38.6	Very low	41.6	Very low	96 Å²	96	137.8 Å²	137.8	79%	0.793	81%	0.808	S	S	*	*			trans	-175.3	84.2	131	0	0	0	0	0	109.1	E54	A52-E54 PolarHBondContact O-N 3.01Å; A52-E54 VanDerWaalsContact O-N 3.16Å
53	E	41.6	Very low	41.2	Very low	199 Å²	199	140.8 Å²	140.8	93%	0.93	81%	0.809	S	S	*	*			trans	-59.7	108.3	155	-72.2	180	143.6	0	0	107.8	K55	E53-K55 PolarHBondContact O-N 2.87Å
54	E	40.8	Very low	41.2	Very low	186 Å²	186	137.6 Å²	137.6	87%	0.869	81%	0.807	S	S	*	*			trans	-79.7	105.2	177	-164.9	173	174.8	0	0	109.3	A52 L56	A52-E54 PolarHBondContact O-N 3.01Å; A52-E54 VanDerWaalsContact O-N 3.16Å; E54-L56 PolarHBondContact O-N 3.36Å
55	K	41.7	Very low	41.4	Very low	196 Å²	196	133.8 Å²	133.8	85%	0.852	79%	0.792	S	S	*	*			trans	-47.2	115.8	171.4	-76.8	179.3	171.5	-174.5	0	111.4	E53	E53-K55 PolarHBondContact O-N 2.87Å
56	L	43.9	Very low	42.3	Very low	160 Å²	160	136.6 Å²	136.6	84%	0.838	79%	0.791	S	S	*	*			trans	-64.3	136.6	157.5	-62.8	171.3	0	0	0	108.8	E54 G58	E54-L56 PolarHBondContact O-N 3.36Å; L56-G58 PolarHBondContact O-N 2.95Å
57	P	45.8	Very low	42.6	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	76%	0.76	S	S	*	*			trans	-65.7	120	171.6	27.6	-30.9	0	0	0	107.9	S59	P57-S59 PolarHBondContact O-N 3.46Å; P57-S59 VanDerWaalsContact O-N 3.07Å
58	G	40.7	Very low	43.7	Very low	77 Å²	77	131 Å²	131	79%	0.794	74%	0.738	S	S	*	*			trans	-52.2	115.8	174.2	0	0	0	0	0	109.6	L56 D60	L56-G58 PolarHBondContact O-N 2.95Å; G58-D60 PolarHBondContact O-N 3.31Å
59	S	40.5	Very low	43.9	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	72%	0.724	S	S	*	*			trans	-62.3	105.5	160.4	-176.8	0	0	0	0	105.8	P57 S61	P57-S59 PolarHBondContact O-N 3.46Å; P57-S59 VanDerWaalsContact O-N 3.07Å; S59-S61 PolarHBondContact O-N 3.42Å
60	D	43.9	Very low	44.6	Very low	145 Å²	145	125.1 Å²	125.1	78%	0.775	72%	0.715	S	S	*	*			trans	-61.4	81.4	166.3	-165.2	40.9	0	0	0	107.5	G58 E62	G58-D60 PolarHBondContact O-N 3.31Å; D60-E62 PolarHBondContact O-N 3.44Å
61	S	41.4	Very low	45.6	Very low	91 Å²	91	127 Å²	127	64%	0.636	71%	0.711	S	S	*	*			trans	-74.1	102.2	164.6	-177.9	0	0	0	0	104.3	S59 D63	S59-S61 PolarHBondContact O-N 3.42Å; S61-D63 PolarHBondContact O-N 2.99Å
62	E	44.2	Very low	46.7	Very low	172 Å²	172	130 Å²	130	80%	0.804	71%	0.712	S	S	*	*			trans	-54.7	91.1	161.1	-72.7	-120.4	134.9	0	0	107.5	D60 S64	D60-E62 PolarHBondContact O-N 3.44Å; E62-S64 PolarHBondContact O-N 2.84Å
63	D	40.6	Very low	48	Very low	126 Å²	126	129.9 Å²	129.9	67%	0.674	69%	0.691	S	S	*	*			trans	-67.4	90	165.3	-165.7	56.2	0	0	0	104.9	S61 D65	S61-D63 PolarHBondContact O-N 2.99Å; D63-D65 PolarHBondContact O-N 3.28Å
64	S	47.9	Very low	49.5	Very low	113 Å²	113	124.1 Å²	124.1	79%	0.79	68%	0.678	S	S	*	*			trans	-67.6	75	166	176.9	0	0	0	0	106.9	E62 D66	E62-S64 PolarHBondContact O-N 2.84Å; S64-D66 VanDerWaalsContact C-N 3.31Å; S64-D66 PolarHBondContact O-N 2.82Å
65	D	44.7	Very low	50.9	Low	105 Å²	105	118.8 Å²	118.8	56%	0.561	67%	0.672	S	S	*	*			trans	-64.4	93.2	172.7	-152	-10.5	0	0	0	106.6	D63 D67	D63-D65 PolarHBondContact O-N 3.28Å; D65-D67 PolarHBondContact O-N 2.81Å
66	D	51.5	Low	52.1	Low	128 Å²	128	114.3 Å²	114.3	68%	0.684	66%	0.661	S	S	*	*			trans	-69.6	71.5	163.8	-161.1	41.9	0	0	0	106.4	S64 D68	S64-D66 VanDerWaalsContact C-N 3.31Å; S64-D66 PolarHBondContact O-N 2.82Å; D66-D68 PolarHBondContact O-N 3.37Å
67	D	48.8	Very low	53.2	Low	40 Å²	40	113.2 Å²	113.2	21%	0.214	65%	0.651	C	S	.	*			trans	-87.1	65.6	168.2	-163.6	-57.1	0	0	0	107.5	D65 L70 R71	D65-D67 PolarHBondContact O-N 2.81Å; D67-L70 WeakPolarHBondContact OD1-CA 3.4Å; D67-L70 WeakPolarHBondContact OD1-CB 3.33Å; D67-L70 PolarHBondContact OD1-N 3.23Å; D67-L70 WeakPolarHBondContact OD2-CD1 3.29Å; D67-L70 WeakPolarHBondContact OD2-CG 3.4Å; D67-R71 WeakPolarHBondContact O-CD 3.39Å; D67-R71 WeakPolarHBondContact O-CG 3.42Å; D67-R71 PolarHBondContact O-NE 3.27Å; D67-R71 VanDerWaalsContact O-NE 3.1Å; D67-R71 PolarHBondContact OD1-N 2.95Å
68	D	55.2	Low	54.3	Low	57 Å²	57	109.7 Å²	109.7	31%	0.305	64%	0.638	S	S	.	*			trans	-86	-1.1	164.5	58	-56	0	0	0	111.1	D66 R73 R87	D66-D68 PolarHBondContact O-N 3.37Å; D68-R73 PolarHBondContact O-NE 3.34Å; D68-R87 IonicContact OD2-NH2 3.46Å; D68-R87 PolarHBondContact OD2-NH2 3.49Å
69	S	55.4	Low	55.8	Low	78 Å²	78	113.1 Å²	113.1	55%	0.545	64%	0.637	S	S	.	*	S	Bend	trans	-101.1	-26.1	-178.3	74.1	0	0	0	0	115.3
70	L	50.6	Low	57.4	Low	136 Å²	136	113.3 Å²	113.3	71%	0.712	63%	0.629	S	S	*	*	S	Bend	trans	-101.9	-14.5	171.9	-48.2	177.6	0	0	0	112.9	D67 K72	D67-L70 WeakPolarHBondContact OD1-CA 3.4Å; D67-L70 WeakPolarHBondContact OD1-CB 3.33Å; D67-L70 PolarHBondContact OD1-N 3.23Å; D67-L70 WeakPolarHBondContact OD2-CD1 3.29Å; D67-L70 WeakPolarHBondContact OD2-CG 3.4Å; L70-K72 PolarHBondContact O-N 2.87Å; L70-K72 VanDerWaalsContact O-N 3.13Å
71	R	59.9	Low	58.8	Low	184 Å²	184	114.4 Å²	114.4	69%	0.694	63%	0.629	S	S	*	*	S	Bend	trans	-61.7	116.1	163.5	-71.1	176.4	-162.9	-121.8	2	108.4	D67 R73	D67-R71 WeakPolarHBondContact O-CD 3.39Å; D67-R71 WeakPolarHBondContact O-CG 3.42Å; D67-R71 PolarHBondContact O-NE 3.27Å; D67-R71 VanDerWaalsContact O-NE 3.1Å; D67-R71 PolarHBondContact OD1-N 2.95Å; R71-R73 VanDerWaalsContact C-N 3.32Å; R71-R73 PolarHBondContact O-N 3.01Å
72	K	63.4	Low	60.7	Low	205 Å²	205	114.4 Å²	114.4	89%	0.891	62%	0.621	S	S	*	*			trans	-54.2	99.2	167.3	-70.6	177.3	-178.5	176.1	0	107.4	L70 A74	L70-K72 PolarHBondContact O-N 2.87Å; L70-K72 VanDerWaalsContact O-N 3.13Å; K72-A74 PolarHBondContact O-N 3.12Å; K72-A74 VanDerWaalsContact O-N 3.15Å
73	R	66.4	Low	62.3	Low	94 Å²	94	114.5 Å²	114.5	36%	0.355	62%	0.621	S	S	.	*			trans	-60	120.7	-179.9	-58.9	-169.4	-154.8	154.9	13.7	107.7	D68 R71 E77	D68-R73 PolarHBondContact O-NE 3.34Å; R71-R73 VanDerWaalsContact C-N 3.32Å; R71-R73 PolarHBondContact O-N 3.01Å; R73-E77 HydrophobicContact CB-CB 4.16Å; R73-E77 WeakPolarHBondContact CD-O 3.32Å; R73-E77 PolarHBondContact NH1-O 3.49Å
74	A	72.7	Confident	64.4	Low	79 Å²	79	112.4 Å²	112.4	65%	0.653	61%	0.61	S	S	*	*			trans	-85	138.3	-177.4	0	0	0	0	0	109.4	K72	K72-A74 PolarHBondContact O-N 3.12Å; K72-A74 VanDerWaalsContact O-N 3.15Å
75	G	70.7	Confident	66	Low	73 Å²	73	113 Å²	113	75%	0.753	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	73.2	-139.2	175.5	0	0	0	0	0	114.4	E77	G75-E77 VanDerWaalsContact C-N 3.32Å; G75-E77 PolarHBondContact O-N 3.37Å
76	V	65.1	Low	67.8	Low	102 Å²	102	114.7 Å²	114.7	62%	0.618	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-78.3	-14.3	-169.5	-178.9	0	0	0	0	113.1	G78 L79 I80	V76-G78 PolarHBondContact O-N 2.95Å; V76-G78 VanDerWaalsContact O-N 3.13Å; V76-L79 WeakPolarHBondContact O-CB 3.41Å; V76-L79 PolarHBondContact O-N 2.9Å; V76-I80 HydrophobicContact CG1-CD1 4.3Å
77	E	67.9	Low	69.2	Low	137 Å²	137	113.1 Å²	113.1	64%	0.64	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-63.5	-18.5	-177.8	-65.7	179.1	168.6	0	0	114.5	R73 G75	R73-E77 HydrophobicContact CB-CB 4.16Å; R73-E77 WeakPolarHBondContact CD-O 3.32Å; R73-E77 PolarHBondContact NH1-O 3.49Å; G75-E77 VanDerWaalsContact C-N 3.32Å; G75-E77 PolarHBondContact O-N 3.37Å
78	G	68.4	Low	70.4	Confident	51 Å²	51	117 Å²	117	53%	0.526	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-93.9	-9.7	173.6	0	0	0	0	0	114.6	V76	V76-G78 PolarHBondContact O-N 2.95Å; V76-G78 VanDerWaalsContact O-N 3.13Å
79	L	71.9	Confident	71.3	Confident	148 Å²	148	117.8 Å²	117.8	78%	0.775	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-19.7	-173.1	-144.5	74.3	0	0	0	112.9	V76	V76-L79 WeakPolarHBondContact O-CB 3.41Å; V76-L79 PolarHBondContact O-N 2.9Å
80	I	74.3	Confident	72.2	Confident	116 Å²	116	122.6 Å²	122.6	60%	0.595	66%	0.658	S	S	*	*	S	Bend	trans	-99.6	119.8	178.1	-57	174	0	0	0	108.6	V76 I82	V76-I80 HydrophobicContact CG1-CD1 4.3Å; I80-I82 PolarHBondContact O-N 3.45Å
81	E	74.5	Confident	73.3	Confident	167 Å²	167	124.5 Å²	124.5	78%	0.78	66%	0.66	S	S	*	*			trans	-72.7	117.8	176.6	-65.5	-179.1	177.8	0	0	109.9	E83	E81-E83 PolarHBondContact O-N 3.45Å; E81-E83 VanDerWaalsContact O-N 3.13Å
82	I	80.4	Confident	73.9	Confident	92 Å²	92	121.8 Å²	121.8	47%	0.472	67%	0.669	S	S	.	*			trans	-83	89.3	178.3	-56.8	171.4	0	0	0	108.3	I80 N84	I80-I82 PolarHBondContact O-N 3.45Å; I82-N84 HydrophobicContact CG2-CB 3.93Å; I82-N84 PolarHBondContact O-N 3.18Å
83	E	78.9	Confident	74.4	Confident	173 Å²	173	119.5 Å²	119.5	81%	0.808	66%	0.66	S	S	*	*			trans	-79.6	53.8	171.6	-66.2	-170	156.2	0	0	111.8	E81 P85	E81-E83 PolarHBondContact O-N 3.45Å; E81-E83 VanDerWaalsContact O-N 3.13Å; E83-P85 VanDerWaalsContact O-CD 3.23Å; E83-P85 WeakPolarHBondContact O-CD 3.46Å
84	N	83.2	Confident	74.9	Confident	82 Å²	82	122.7 Å²	122.7	44%	0.439	68%	0.676	S	S	.	*			trans	-83.2	112.9	173.8	178.2	-7	0	0	0	109	I82 N86 R87	I82-N84 HydrophobicContact CG2-CB 3.93Å; I82-N84 PolarHBondContact O-N 3.18Å; N84-N86 PolarHBondContact O-N 2.78Å; N84-N86 VanDerWaalsContact O-N 3.16Å; N84-N86 PolarHBondContact OD1-N 3.42Å; N84-R87 HydrophobicContact CB-CB 3.76Å; N84-R87 WeakPolarHBondContact O-CB 3.22Å; N84-R87 PolarHBondContact O-N 3.36Å
85	P	82.8	Confident	74.7	Confident	125 Å²	125	124.9 Å²	124.9	81%	0.812	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-18.9	-177.3	26.2	-34.7	0	0	0	113.8	E83	E83-P85 VanDerWaalsContact O-CD 3.23Å; E83-P85 WeakPolarHBondContact O-CD 3.46Å
86	N	82.3	Confident	74.7	Confident	141 Å²	141	127.7 Å²	127.7	75%	0.754	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-1.9	173.5	-67	-31.5	0	0	0	112.8	N84 V88	N84-N86 PolarHBondContact O-N 2.78Å; N84-N86 VanDerWaalsContact O-N 3.16Å; N84-N86 PolarHBondContact OD1-N 3.42Å; N86-V88 PolarHBondContact O-N 3.18Å
87	R	80.9	Confident	74.7	Confident	96 Å²	96	129.6 Å²	129.6	36%	0.362	69%	0.686	S	S	.	*			trans	-81.3	107.7	-179.5	-173.4	170.7	-174.2	-110.7	-2.6	109.6	D68 N84 A89	D68-R87 IonicContact OD2-NH2 3.46Å; D68-R87 PolarHBondContact OD2-NH2 3.49Å; N84-R87 HydrophobicContact CB-CB 3.76Å; N84-R87 WeakPolarHBondContact O-CB 3.22Å; N84-R87 PolarHBondContact O-N 3.36Å; R87-A89 PolarHBondContact O-N 2.9Å
88	V	74.5	Confident	74.6	Confident	121 Å²	121	127.4 Å²	127.4	73%	0.733	68%	0.678	S	S	*	*			trans	-80	104.2	178	-174.4	0	0	0	0	108.9	N86 Q90	N86-V88 PolarHBondContact O-N 3.18Å; V88-Q90 PolarHBondContact O-N 3.41Å
89	A	73.4	Confident	74.3	Confident	73 Å²	73	133.1 Å²	133.1	60%	0.603	69%	0.691	S	S	*	*			trans	-72.1	109.2	174	0	0	0	0	0	110.2	R87 K91	R87-A89 PolarHBondContact O-N 2.9Å; A89-K91 PolarHBondContact O-N 3.41Å; A89-K91 VanDerWaalsContact O-N 3.1Å
90	Q	74.3	Confident	73.7	Confident	179 Å²	179	133.5 Å²	133.5	84%	0.836	69%	0.693	S	S	*	*			trans	-67	104.6	172.9	-67.6	-84.6	-15.7	0	0	108.9	V88	V88-Q90 PolarHBondContact O-N 3.41Å
91	K	73.8	Confident	72.9	Confident	177 Å²	177	135.6 Å²	135.6	77%	0.77	71%	0.705	S	S	*	*			trans	-90.9	120.4	170.8	-64.2	-178	-176.5	178.8	0	108	A89 K93	A89-K91 PolarHBondContact O-N 3.41Å; A89-K91 VanDerWaalsContact O-N 3.1Å; K91-K93 PolarHBondContact O-N 2.87Å
92	S	72.6	Confident	72.2	Confident	126 Å²	126	135.3 Å²	135.3	88%	0.881	70%	0.704	S	S	*	*			trans	-64.8	101.5	174.6	48.2	0	0	0	0	110.1
93	K	73.9	Confident	71.2	Confident	158 Å²	158	136.5 Å²	136.5	69%	0.687	72%	0.717	S	S	*	*			trans	-83.5	139.4	172.9	-67.5	-178	-177.6	179.2	0	109.2	K91	K91-K93 PolarHBondContact O-N 2.87Å
94	K	76.7	Confident	70.6	Confident	160 Å²	160	139.4 Å²	139.4	70%	0.696	72%	0.721	S	S	*	*			trans	-68.4	138	173.4	-64.9	179.8	-179.2	179	0	108.7	T96 Q97	K94-T96 PolarHBondContact O-N 3.5Å; K94-Q97 PolarHBondContact O-N 2.81Å
95	V	68.3	Low	69.6	Low	125 Å²	125	143 Å²	143	76%	0.758	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-51.5	-30.4	-176.3	-179.3	0	0	0	0	112.7	Q97 I98	V95-Q97 VanDerWaalsContact C-N 3.28Å; V95-Q97 PolarHBondContact O-N 2.83Å; V95-I98 PolarHBondContact O-N 3.07Å
96	T	70.3	Confident	68.6	Low	133 Å²	133	141.1 Å²	141.1	82%	0.816	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-72.9	-10.6	179.6	59.9	0	0	0	0	115.2	K94	K94-T96 PolarHBondContact O-N 3.5Å
97	Q	64.6	Low	68.1	Low	141 Å²	141	137 Å²	137	66%	0.659	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-108.1	6.6	179.2	-74.4	179.1	-26.2	0	0	112.8	K94 V95 E99	K94-Q97 PolarHBondContact O-N 2.81Å; V95-Q97 VanDerWaalsContact C-N 3.28Å; V95-Q97 PolarHBondContact O-N 2.83Å; Q97-E99 PolarHBondContact O-N 3.22Å
98	I	66.3	Low	67.8	Low	91 Å²	91	142 Å²	142	47%	0.467	72%	0.719	S	S	.	*			trans	-83	97	173	-56.3	174.5	0	0	0	106.3	V95 L100	V95-I98 PolarHBondContact O-N 3.07Å; I98-L100 HydrophobicContact CG2-CD2 4.05Å; I98-L100 HydrophobicContact CG2-CG 4.34Å; I98-L100 PolarHBondContact O-N 2.91Å
99	E	62.3	Low	67.8	Low	172 Å²	172	145.8 Å²	145.8	80%	0.804	72%	0.72	S	S	*	*			trans	-63.8	102.8	168.6	-70.8	174.2	171.8	0	0	108.1	Q97 D101	Q97-E99 PolarHBondContact O-N 3.22Å; E99-D101 PolarHBondContact O-N 2.84Å
100	L	60.2	Low	68.2	Low	155 Å²	155	146.6 Å²	146.6	81%	0.812	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	1	180	-70.3	167.2	0	0	0	113	I98	I98-L100 HydrophobicContact CG2-CD2 4.05Å; I98-L100 HydrophobicContact CG2-CG 4.34Å; I98-L100 PolarHBondContact O-N 2.91Å
101	D	55.8	Low	68.6	Low	160 Å²	160	143.2 Å²	143.2	86%	0.856	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-4.9	-171	-78.9	-25.7	0	0	0	114.5	E99	E99-D101 PolarHBondContact O-N 2.84Å
102	E	61.3	Low	69.2	Low	162 Å²	162	140.2 Å²	140.2	76%	0.757	68%	0.679	S	S	*	*	S	Bend	trans	-77	124.5	169.7	-78.2	-167.9	160.1	0	0	109.9	R104	E102-R104 PolarHBondContact O-N 3.17Å
103	P	59.5	Low	69.9	Low	116 Å²	116	140 Å²	140	75%	0.753	66%	0.664	S	S	*	*			trans	-59.6	106.1	177.6	23.8	-31.7	0	0	0	107.9	Q105	P103-Q105 PolarHBondContact O-N 3.47Å
104	R	64.8	Low	70.5	Confident	234 Å²	234	135.1 Å²	135.1	88%	0.883	65%	0.645	S	S	*	*			trans	-45.6	112.7	177.9	-149.9	176.8	-168.4	-175	2.7	106.8	E102 L106	E102-R104 PolarHBondContact O-N 3.17Å; R104-L106 VanDerWaalsContact C-N 3.33Å; R104-L106 PolarHBondContact O-N 2.91Å
105	Q	61.9	Low	71.2	Confident	159 Å²	159	133.8 Å²	133.8	74%	0.743	64%	0.641	S	S	*	*			trans	-59.8	101.9	-176.8	-71.9	-141.3	18.2	0	0	107.5	P103 S107	P103-Q105 PolarHBondContact O-N 3.47Å; Q105-S107 PolarHBondContact O-N 2.9Å
106	L	61.9	Low	72.4	Confident	85 Å²	85	134.3 Å²	134.3	45%	0.445	63%	0.634	S	S	.	*			trans	-44.4	131.2	-179.9	-69.7	163.1	0	0	0	108.3	R104 E110 R111 I114	R104-L106 VanDerWaalsContact C-N 3.33Å; R104-L106 PolarHBondContact O-N 2.91Å; L106-E110 WeakPolarHBondContact CA-OE2 3.47Å; L106-E110 HydrophobicContact CB-CB 4.07Å; L106-E110 HydrophobicContact CD2-CB 4.32Å; L106-E110 WeakPolarHBondContact CD2-OE2 3.21Å; L106-R111 HydrophobicContact CB-CG 3.84Å; L106-R111 PolarHBondContact O-NE 3.25Å; L106-I114 HydrophobicContact CD1-CD1 3.75Å
107	S	73.7	Confident	73.6	Confident	53 Å²	53	133.3 Å²	133.3	37%	0.371	62%	0.62	S	S	.	*			trans	-55.6	151.9	-176.3	83.1	0	0	0	0	108.9	Q105 R109 E110 R111	Q105-S107 PolarHBondContact O-N 2.9Å; S107-R109 PolarHBondContact O-N 2.93Å; S107-E110 PolarHBondContact N-OE2 2.91Å; S107-E110 WeakPolarHBondContact O-CB 3.18Å; S107-E110 PolarHBondContact O-N 3.48Å; S107-E110 WeakPolarHBondContact OG-CG 3.24Å; S107-E110 PolarHBondContact OG-N 3.49Å; S107-R111 PolarHBondContact O-N 3.36Å
108	R	74.8	Confident	75	Confident	203 Å²	203	132.7 Å²	132.7	77%	0.766	62%	0.615	S	S	*	*	H	α-helix	trans	-49.7	-34.3	-179.1	-171.8	176.3	176.4	174.7	2.2	112.3	E112	R108-E112 IonicContact NE-OE1 3.71Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 2.94Å
109	R	74.3	Confident	76.4	Confident	200 Å²	200	131.2 Å²	131.2	76%	0.755	62%	0.616	S	S	*	*	H	α-helix	trans	-66.5	-46.4	175.3	-66.4	-178.3	177.7	170.6	0	112.7	S107 R111 E112 E113	S107-R109 PolarHBondContact O-N 2.93Å; R109-R111 VanDerWaalsContact C-N 3.33Å; R109-R111 PolarHBondContact O-N 3.41Å; R109-E112 PolarHBondContact O-N 2.9Å; R109-E113 WeakPolarHBondContact O-CG 3.38Å; R109-E113 PolarHBondContact O-N 3.29Å
110	E	81.6	Confident	77.9	Confident	89 Å²	89	129.2 Å²	129.2	42%	0.416	61%	0.605	S	S	.	*	H	α-helix	trans	-65.1	-36.4	179.7	-69.5	161.7	-172.1	0	0	112	L106 S107 E113 I114	L106-E110 WeakPolarHBondContact CA-OE2 3.47Å; L106-E110 HydrophobicContact CB-CB 4.07Å; L106-E110 HydrophobicContact CD2-CB 4.32Å; L106-E110 WeakPolarHBondContact CD2-OE2 3.21Å; S107-E110 PolarHBondContact N-OE2 2.91Å; S107-E110 WeakPolarHBondContact O-CB 3.18Å; S107-E110 PolarHBondContact O-N 3.48Å; S107-E110 WeakPolarHBondContact OG-CG 3.24Å; S107-E110 PolarHBondContact OG-N 3.49Å; E110-E113 PolarHBondContact O-N 3Å; E110-I114 WeakPolarHBondContact O-CB 3.26Å; E110-I114 WeakPolarHBondContact O-CD1 3.47Å; E110-I114 VanDerWaalsContact O-CG1 3.25Å; E110-I114 WeakPolarHBondContact O-CG1 3.42Å; E110-I114 PolarHBondContact O-N 2.91Å
111	R	82.7	Confident	79.6	Confident	109 Å²	109	128 Å²	128	41%	0.411	59%	0.594	S	S	.	*	H	α-helix	trans	-63.1	-47.9	175.7	-67.2	-177.5	-176.4	178	-1.6	111.8	L106 S107 R109 E113 I114 E115	L106-R111 HydrophobicContact CB-CG 3.84Å; L106-R111 PolarHBondContact O-NE 3.25Å; S107-R111 PolarHBondContact O-N 3.36Å; R109-R111 VanDerWaalsContact C-N 3.33Å; R109-R111 PolarHBondContact O-N 3.41Å; R111-E113 VanDerWaalsContact C-N 3.32Å; R111-E113 PolarHBondContact O-N 3.36Å; R111-I114 PolarHBondContact O-N 3.26Å; R111-E115 WeakPolarHBondContact O-CB 3.38Å; R111-E115 WeakPolarHBondContact O-CG 3.46Å; R111-E115 PolarHBondContact O-N 3.45Å
112	E	85.6	Confident	81.4	Confident	114 Å²	114	129.2 Å²	129.2	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-64.9	-36.5	178.9	-70.9	175.5	-166.6	0	0	111.7	R108 R109 K116	R108-E112 IonicContact NE-OE1 3.71Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 2.94Å; R109-E112 PolarHBondContact O-N 2.9Å; E112-K116 VanDerWaalsContact O-CB 3.26Å; E112-K116 WeakPolarHBondContact O-CB 3.27Å; E112-K116 PolarHBondContact O-N 2.99Å
113	E	87.6	Confident	83	Confident	121 Å²	121	127 Å²	127	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-67.3	-44.1	175.6	-76.6	179.2	-175.4	0	0	112.7	R109 E110 R111 E115 K116 Q117	R109-E113 WeakPolarHBondContact O-CG 3.38Å; R109-E113 PolarHBondContact O-N 3.29Å; E110-E113 PolarHBondContact O-N 3Å; R111-E113 VanDerWaalsContact C-N 3.32Å; R111-E113 PolarHBondContact O-N 3.36Å; E113-E115 VanDerWaalsContact C-N 3.34Å; E113-E115 PolarHBondContact O-N 2.91Å; E113-K116 PolarHBondContact O-N 3.45Å; E113-Q117 WeakPolarHBondContact O-CG 3.27Å; E113-Q117 PolarHBondContact O-N 3.46Å
114	I	87.2	Confident	84.7	Confident	56 Å²	56	126.4 Å²	126.4	29%	0.287	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-41.1	176.3	-70.2	164.5	0	0	0	110.7	L106 E110 R111 Q117 K118	L106-I114 HydrophobicContact CD1-CD1 3.75Å; E110-I114 WeakPolarHBondContact O-CB 3.26Å; E110-I114 WeakPolarHBondContact O-CD1 3.47Å; E110-I114 VanDerWaalsContact O-CG1 3.25Å; E110-I114 WeakPolarHBondContact O-CG1 3.42Å; E110-I114 PolarHBondContact O-N 2.91Å; R111-I114 PolarHBondContact O-N 3.26Å; I114-Q117 PolarHBondContact O-N 3.17Å; I114-K118 HydrophobicContact CG2-CD 3.91Å; I114-K118 VanDerWaalsContact CG2-CE 3.46Å; I114-K118 HydrophobicContact CG2-CG 4.39Å; I114-K118 WeakPolarHBondContact O-CB 3.41Å; I114-K118 VanDerWaalsContact O-CG 3.26Å; I114-K118 WeakPolarHBondContact O-CG 3.43Å; I114-K118 PolarHBondContact O-N 2.84Å
115	E	89.9	Confident	86.2	Confident	131 Å²	131	122.9 Å²	122.9	61%	0.612	55%	0.552	S	S	*	*	H	α-helix	trans	-65.1	-40.3	175.7	-75.9	-179.7	-172.7	0	0	112	R111 E113 Q117 K118 A119	R111-E115 WeakPolarHBondContact O-CB 3.38Å; R111-E115 WeakPolarHBondContact O-CG 3.46Å; R111-E115 PolarHBondContact O-N 3.45Å; E113-E115 VanDerWaalsContact C-N 3.34Å; E113-E115 PolarHBondContact O-N 2.91Å; E115-Q117 VanDerWaalsContact C-N 3.34Å; E115-Q117 PolarHBondContact O-N 2.91Å; E115-K118 PolarHBondContact O-N 2.87Å; E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.3Å; E115-A119 PolarHBondContact O-N 3.19Å
116	K	94.6	Very high	87.8	Confident	137 Å²	137	118.9 Å²	118.9	60%	0.596	53%	0.534	S	S	*	.	H	α-helix	trans	-62.7	-41.5	174.9	-173.1	178.2	-175	178.6	0	111.7	E112 E113 A119 K120	E112-K116 VanDerWaalsContact O-CB 3.26Å; E112-K116 WeakPolarHBondContact O-CB 3.27Å; E112-K116 PolarHBondContact O-N 2.99Å; E113-K116 PolarHBondContact O-N 3.45Å; K116-A119 PolarHBondContact O-N 2.82Å; K116-K120 WeakPolarHBondContact O-CG 3.49Å; K116-K120 PolarHBondContact O-N 3.39Å; K116-K120 VanDerWaalsContact O-N 3.07Å
117	Q	94.5	Very high	89.5	Confident	112 Å²	112	117.4 Å²	117.4	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-63.7	-50.5	174.3	-72.3	176.1	1.6	0	0	111.1	E113 I114 E115 A119 K120 E121	E113-Q117 WeakPolarHBondContact O-CG 3.27Å; E113-Q117 PolarHBondContact O-N 3.46Å; I114-Q117 PolarHBondContact O-N 3.17Å; E115-Q117 VanDerWaalsContact C-N 3.34Å; E115-Q117 PolarHBondContact O-N 2.91Å; Q117-A119 VanDerWaalsContact C-N 3.28Å; Q117-A119 PolarHBondContact O-N 3.33Å; Q117-K120 WeakPolarHBondContact O-CB 3.28Å; Q117-K120 PolarHBondContact O-N 3.37Å; Q117-K120 VanDerWaalsContact O-N 3.12Å; Q117-E121 WeakPolarHBondContact O-CG 3.29Å; Q117-E121 PolarHBondContact O-N 3.48Å
118	K	95.4	Very high	90.4	Very high	128 Å²	128	121.9 Å²	121.9	56%	0.557	54%	0.544	S	S	*	.	H	α-helix	trans	-57.9	-38.3	176.5	-74	173.6	179.2	174.4	0	112.7	I114 E115 R122	I114-K118 HydrophobicContact CG2-CD 3.91Å; I114-K118 VanDerWaalsContact CG2-CE 3.46Å; I114-K118 HydrophobicContact CG2-CG 4.39Å; I114-K118 WeakPolarHBondContact O-CB 3.41Å; I114-K118 VanDerWaalsContact O-CG 3.26Å; I114-K118 WeakPolarHBondContact O-CG 3.43Å; I114-K118 PolarHBondContact O-N 2.84Å; E115-K118 PolarHBondContact O-N 2.87Å; K118-R122 VanDerWaalsContact O-CB 3.24Å; K118-R122 WeakPolarHBondContact O-CB 3.33Å; K118-R122 PolarHBondContact O-N 3.5Å
119	A	94.5	Very high	91.3	Very high	59 Å²	59	115.1 Å²	115.1	49%	0.488	53%	0.532	S	S	.	.	H	α-helix	trans	-66.4	-43.7	177	0	0	0	0	0	111.8	E115 K116 Q117 R122 Y123	E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.3Å; E115-A119 PolarHBondContact O-N 3.19Å; K116-A119 PolarHBondContact O-N 2.82Å; Q117-A119 VanDerWaalsContact C-N 3.28Å; Q117-A119 PolarHBondContact O-N 3.33Å; A119-R122 PolarHBondContact O-N 3.38Å; A119-Y123 WeakPolarHBondContact O-CB 3.28Å; A119-Y123 PolarHBondContact O-N 2.99Å
120	K	94.6	Very high	92.2	Very high	131 Å²	131	106.1 Å²	106.1	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-61.6	-48.1	173.8	-72.6	175.3	177.4	-171.8	0	111.2	K116 Q117 R122 Y123 M124	K116-K120 WeakPolarHBondContact O-CG 3.49Å; K116-K120 PolarHBondContact O-N 3.39Å; K116-K120 VanDerWaalsContact O-N 3.07Å; Q117-K120 WeakPolarHBondContact O-CB 3.28Å; Q117-K120 PolarHBondContact O-N 3.37Å; Q117-K120 VanDerWaalsContact O-N 3.12Å; K120-R122 VanDerWaalsContact C-N 3.32Å; K120-R122 PolarHBondContact O-N 3.49Å; K120-Y123 WeakPolarHBondContact O-CB 3.44Å; K120-Y123 PolarHBondContact O-N 3.31Å; K120-M124 WeakPolarHBondContact O-CB 3.47Å; K120-M124 VanDerWaalsContact O-CG 3.29Å; K120-M124 WeakPolarHBondContact O-CG 3.38Å; K120-M124 PolarHBondContact O-N 3.14Å
121	E	94.6	Very high	92.8	Very high	128 Å²	128	107.8 Å²	107.8	60%	0.598	51%	0.507	S	S	*	.	H	α-helix	trans	-59.6	-43.4	177.2	-72.7	175.5	-176.9	0	0	111.9	Q117 Y123 M124 K125	Q117-E121 WeakPolarHBondContact O-CG 3.29Å; Q117-E121 PolarHBondContact O-N 3.48Å; E121-Y123 VanDerWaalsContact C-N 3.35Å; E121-Y123 PolarHBondContact O-N 2.95Å; E121-M124 PolarHBondContact O-N 2.94Å; E121-K125 WeakPolarHBondContact O-CB 3.48Å; E121-K125 PolarHBondContact O-N 3.11Å
122	R	95.2	Very high	93.5	Very high	186 Å²	186	103.5 Å²	103.5	70%	0.702	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-43.3	176.1	-175.6	-178.5	177.6	-167.6	-0.5	111.2	K118 A119 K120 K125 M126	K118-R122 VanDerWaalsContact O-CB 3.24Å; K118-R122 WeakPolarHBondContact O-CB 3.33Å; K118-R122 PolarHBondContact O-N 3.5Å; A119-R122 PolarHBondContact O-N 3.38Å; K120-R122 VanDerWaalsContact C-N 3.32Å; K120-R122 PolarHBondContact O-N 3.49Å; R122-K125 PolarHBondContact O-N 3.21Å; R122-M126 HydrophobicContact CG-CG 4.5Å; R122-M126 WeakPolarHBondContact O-CB 3.48Å; R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 2.89Å
123	Y	94.8	Very high	93.8	Very high	115 Å²	115	104 Å²	104	45%	0.451	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-49.9	175.6	177.4	-92.4	0	0	0	111	A119 K120 E121 K125 M126 H127 T132	A119-Y123 WeakPolarHBondContact O-CB 3.28Å; A119-Y123 PolarHBondContact O-N 2.99Å; K120-Y123 WeakPolarHBondContact O-CB 3.44Å; K120-Y123 PolarHBondContact O-N 3.31Å; E121-Y123 VanDerWaalsContact C-N 3.35Å; E121-Y123 PolarHBondContact O-N 2.95Å; Y123-K125 VanDerWaalsContact C-N 3.34Å; Y123-K125 PolarHBondContact O-N 2.92Å; Y123-M126 PolarHBondContact O-N 3.4Å; Y123-H127 WeakPolarHBondContact O-CB 3.32Å; Y123-H127 PolarHBondContact O-N 3.39Å; Y123-T132 HydrophobicContact CD2-CG2 4.45Å; Y123-T132 HydrophobicContact CE2-CG2 4.01Å
124	M	95.4	Very high	94.1	Very high	105 Å²	105	103.9 Å²	103.9	52%	0.517	50%	0.499	S	S	.	.	H	α-helix	trans	-60.3	-43.7	178	-68.6	-57.5	-73.4	0	0	111.4	K120 E121 M126 H127 L128	K120-M124 WeakPolarHBondContact O-CB 3.47Å; K120-M124 VanDerWaalsContact O-CG 3.29Å; K120-M124 WeakPolarHBondContact O-CG 3.38Å; K120-M124 PolarHBondContact O-N 3.14Å; E121-M124 PolarHBondContact O-N 2.94Å; M124-M126 PolarHBondContact O-N 3.02Å; M124-H127 PolarHBondContact O-N 3.15Å; M124-L128 WeakPolarHBondContact O-CB 3.28Å; M124-L128 VanDerWaalsContact O-CG 3.28Å; M124-L128 WeakPolarHBondContact O-CG 3.23Å; M124-L128 PolarHBondContact O-N 3.27Å
125	K	96.1	Very high	94.5	Very high	159 Å²	159	101.6 Å²	101.6	69%	0.691	49%	0.489	S	S	*	.	H	α-helix	trans	-61	-43.1	175.4	-175.3	174.3	-176.4	173.1	0	112	E121 R122 Y123 H127 A129	E121-K125 WeakPolarHBondContact O-CB 3.48Å; E121-K125 PolarHBondContact O-N 3.11Å; R122-K125 PolarHBondContact O-N 3.21Å; Y123-K125 VanDerWaalsContact C-N 3.34Å; Y123-K125 PolarHBondContact O-N 2.92Å; K125-H127 VanDerWaalsContact C-N 3.33Å; K125-A129 VanDerWaalsContact O-CB 3.22Å; K125-A129 WeakPolarHBondContact O-CB 3.4Å; K125-A129 PolarHBondContact O-N 3.44Å
126	M	95.8	Very high	94.8	Very high	75 Å²	75	100.5 Å²	100.5	37%	0.369	48%	0.482	S	S	.	.	H	α-helix	trans	-67.7	-34.9	176.2	-71.3	-71.7	-74.2	0	0	111.9	R122 Y123 M124 A129 G130 K131 T132	R122-M126 HydrophobicContact CG-CG 4.5Å; R122-M126 WeakPolarHBondContact O-CB 3.48Å; R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 2.89Å; Y123-M126 PolarHBondContact O-N 3.4Å; M124-M126 PolarHBondContact O-N 3.02Å; M126-A129 PolarHBondContact O-N 3.32Å; M126-G130 PolarHBondContact O-N 2.98Å; M126-K131 HydrophobicContact CE-CB 3.66Å; M126-K131 HydrophobicContact CE-CD 3.64Å; M126-K131 HydrophobicContact CE-CG 4.3Å; M126-K131 WeakPolarHBondContact O-CB 3.12Å; M126-K131 PolarHBondContact O-N 2.92Å; M126-K131 HydrophobicContact SD-CB 4.27Å; M126-K131 HydrophobicContact SD-CD 3.63Å; M126-T132 HydrophobicContact CB-CG2 4.36Å
127	H	95.6	Very high	94.9	Very high	54 Å²	54	95.9 Å²	95.9	25%	0.25	47%	0.47	C	S	.	.	H	α-helix	trans	-68.4	-48.2	177.1	-168.8	100.7	0	0	0	111.2	Y123 M124 K125 A129 G130 T132 A135	Y123-H127 WeakPolarHBondContact O-CB 3.32Å; Y123-H127 PolarHBondContact O-N 3.39Å; M124-H127 PolarHBondContact O-N 3.15Å; K125-H127 VanDerWaalsContact C-N 3.33Å; H127-A129 VanDerWaalsContact C-N 3.27Å; H127-A129 PolarHBondContact O-N 2.85Å; H127-G130 WeakPolarHBondContact O-CA 3.45Å; H127-G130 PolarHBondContact O-N 3.29Å; H127-T132 WeakPolarHBondContact CA-OG1 3.09Å; H127-T132 HydrophobicContact CB-CG2 3.8Å; H127-T132 PolarHBondContact ND1-OG1 3.37Å; H127-A135 VanDerWaalsContact O-CB 3.27Å; H127-A135 WeakPolarHBondContact O-CB 3.35Å
128	L	92.9	Very high	95	Very high	147 Å²	147	94.1 Å²	94.1	77%	0.77	46%	0.464	S	S	*	.	H	α-helix	trans	-60.6	-37.3	174	-68.9	173.9	0	0	0	112.1	M124 G130	M124-L128 WeakPolarHBondContact O-CB 3.28Å; M124-L128 VanDerWaalsContact O-CG 3.28Å; M124-L128 WeakPolarHBondContact O-CG 3.23Å; M124-L128 PolarHBondContact O-N 3.27Å; L128-G130 PolarHBondContact O-N 2.88Å
129	A	93.9	Very high	95	Very high	61 Å²	61	92.5 Å²	92.5	50%	0.504	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.4	173.6	0	0	0	0	0	113.8	K125 M126 H127 K131	K125-A129 VanDerWaalsContact O-CB 3.22Å; K125-A129 WeakPolarHBondContact O-CB 3.4Å; K125-A129 PolarHBondContact O-N 3.44Å; M126-A129 PolarHBondContact O-N 3.32Å; H127-A129 VanDerWaalsContact C-N 3.27Å; H127-A129 PolarHBondContact O-N 2.85Å; A129-K131 VanDerWaalsContact C-N 3.28Å; A129-K131 HydrophobicContact CB-CD 4.29Å; A129-K131 HydrophobicContact CB-CG 4.21Å; A129-K131 PolarHBondContact O-N 3.37Å
130	G	94.3	Very high	95.1	Very high	12 Å²	12	92.2 Å²	92.2	12%	0.124	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	17.1	179.9	0	0	0	0	0	114.2	M126 H127 L128 K136	M126-G130 PolarHBondContact O-N 2.98Å; H127-G130 WeakPolarHBondContact O-CA 3.45Å; H127-G130 PolarHBondContact O-N 3.29Å; L128-G130 PolarHBondContact O-N 2.88Å; G130-K136 WeakPolarHBondContact O-CG 3.47Å
131	K	94.4	Very high	95.2	Very high	123 Å²	123	93.5 Å²	93.5	54%	0.535	46%	0.459	S	S	.	.			trans	-92.3	-19.2	-174.7	-66.5	179.3	179.3	178.8	0	113.5	M126 A129 K136	M126-K131 HydrophobicContact CE-CB 3.66Å; M126-K131 HydrophobicContact CE-CD 3.64Å; M126-K131 HydrophobicContact CE-CG 4.3Å; M126-K131 WeakPolarHBondContact O-CB 3.12Å; M126-K131 PolarHBondContact O-N 2.92Å; M126-K131 HydrophobicContact SD-CB 4.27Å; M126-K131 HydrophobicContact SD-CD 3.63Å; A129-K131 VanDerWaalsContact C-N 3.28Å; A129-K131 HydrophobicContact CB-CD 4.29Å; A129-K131 HydrophobicContact CB-CG 4.21Å; A129-K131 PolarHBondContact O-N 3.37Å; K131-K136 WeakPolarHBondContact O-CE 3.28Å; K131-K136 PolarHBondContact O-NZ 3.17Å; K131-K136 VanDerWaalsContact O-NZ 3.14Å
132	T	95.4	Very high	95.3	Very high	19 Å²	19	91.4 Å²	91.4	12%	0.117	45%	0.452	C	S	.	.	S	Bend	trans	-71.2	149.6	171	57.7	0	0	0	0	110	Y123 M126 H127 Q134 A135 K136	Y123-T132 HydrophobicContact CD2-CG2 4.45Å; Y123-T132 HydrophobicContact CE2-CG2 4.01Å; M126-T132 HydrophobicContact CB-CG2 4.36Å; H127-T132 WeakPolarHBondContact CA-OG1 3.09Å; H127-T132 HydrophobicContact CB-CG2 3.8Å; H127-T132 PolarHBondContact ND1-OG1 3.37Å; T132-Q134 PolarHBondContact O-N 3.44Å; T132-A135 PolarHBondContact O-N 3.28Å; T132-A135 VanDerWaalsContact O-N 3.15Å; T132-A135 VanDerWaalsContact OG1-CB 3.25Å; T132-A135 WeakPolarHBondContact OG1-CB 3.41Å; T132-A135 PolarHBondContact OG1-N 2.95Å; T132-K136 WeakPolarHBondContact O-CG 3.38Å; T132-K136 PolarHBondContact O-N 2.92Å
133	D	93.4	Very high	95.4	Very high	124 Å²	124	84.5 Å²	84.5	66%	0.663	44%	0.435	S	S	*	.	H	α-helix	trans	-65.2	-30.5	-175.7	-58.7	-33.4	0	0	0	112.4	K136 A137	D133-K136 IonicContact OD1-NZ 3.79Å; D133-K136 PolarHBondContact OD1-NZ 3.24Å; D133-A137 WeakPolarHBondContact O-CB 3.18Å; D133-A137 PolarHBondContact O-N 2.86Å
134	Q	92.9	Very high	95.5	Very high	119 Å²	119	83.6 Å²	83.6	56%	0.556	44%	0.437	S	S	*	.	H	α-helix	trans	-61.8	-52.6	170.9	-68.1	176.3	-8.8	0	0	111.7	T132 K136 A137 D138	T132-Q134 PolarHBondContact O-N 3.44Å; Q134-K136 VanDerWaalsContact C-N 3.32Å; Q134-K136 PolarHBondContact O-N 3.42Å; Q134-A137 WeakPolarHBondContact O-CB 3.37Å; Q134-A137 PolarHBondContact O-N 3.33Å; Q134-A137 VanDerWaalsContact O-N 3.13Å; Q134-D138 PolarHBondContact O-N 3.38Å
135	A	95.9	Very high	95.6	Very high	9 Å²	9	82.1 Å²	82.1	7%	0.074	43%	0.43	C	S	.	.	H	α-helix	trans	-66.5	-35	-178.9	0	0	0	0	0	111.9	H127 T132 D138 L139	H127-A135 VanDerWaalsContact O-CB 3.27Å; H127-A135 WeakPolarHBondContact O-CB 3.35Å; T132-A135 PolarHBondContact O-N 3.28Å; T132-A135 VanDerWaalsContact O-N 3.15Å; T132-A135 VanDerWaalsContact OG1-CB 3.25Å; T132-A135 WeakPolarHBondContact OG1-CB 3.41Å; T132-A135 PolarHBondContact OG1-N 2.95Å; A135-D138 PolarHBondContact O-N 3.45Å; A135-L139 WeakPolarHBondContact O-CB 3.25Å; A135-L139 VanDerWaalsContact O-CG 3.28Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 3.37Å
136	K	95.5	Very high	95.7	Very high	107 Å²	107	81.2 Å²	81.2	47%	0.465	42%	0.422	S	S	.	.	H	α-helix	trans	-60.8	-44.8	171	-70.5	177.3	-170.3	151.9	0	111.9	G130 K131 T132 D133 Q134 D138 L139 A140	G130-K136 WeakPolarHBondContact O-CG 3.47Å; K131-K136 WeakPolarHBondContact O-CE 3.28Å; K131-K136 PolarHBondContact O-NZ 3.17Å; K131-K136 VanDerWaalsContact O-NZ 3.14Å; T132-K136 WeakPolarHBondContact O-CG 3.38Å; T132-K136 PolarHBondContact O-N 2.92Å; D133-K136 IonicContact OD1-NZ 3.79Å; D133-K136 PolarHBondContact OD1-NZ 3.24Å; Q134-K136 VanDerWaalsContact C-N 3.32Å; Q134-K136 PolarHBondContact O-N 3.42Å; K136-D138 VanDerWaalsContact C-N 3.34Å; K136-L139 PolarHBondContact O-N 3.45Å; K136-A140 WeakPolarHBondContact O-CB 3.33Å; K136-A140 PolarHBondContact O-N 2.97Å
137	A	97.4	Very high	95.8	Very high	41 Å²	41	83.9 Å²	83.9	34%	0.339	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-42.6	178.3	0	0	0	0	0	111.4	D133 Q134 A140 R141	D133-A137 WeakPolarHBondContact O-CB 3.18Å; D133-A137 PolarHBondContact O-N 2.86Å; Q134-A137 WeakPolarHBondContact O-CB 3.37Å; Q134-A137 PolarHBondContact O-N 3.33Å; Q134-A137 VanDerWaalsContact O-N 3.13Å; A137-A140 PolarHBondContact O-N 2.86Å; A137-R141 WeakPolarHBondContact O-CG 3.38Å; A137-R141 PolarHBondContact O-N 2.98Å
138	D	96	Very high	95.9	Very high	74 Å²	74	87 Å²	87	40%	0.396	45%	0.447	S	S	.	.	H	α-helix	trans	-68.8	-39.8	177.9	-70.2	-24.5	0	0	0	112.3	Q134 A135 K136 A140 R141 L142	Q134-D138 PolarHBondContact O-N 3.38Å; A135-D138 PolarHBondContact O-N 3.45Å; K136-D138 VanDerWaalsContact C-N 3.34Å; D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 2.9Å; D138-R141 PolarHBondContact O-N 3.41Å; D138-R141 IonicContact OD1-CZ 3.89Å; D138-R141 IonicContact OD1-NH1 2.86Å; D138-R141 PolarHBondContact OD1-NH1 3.31Å; D138-L142 WeakPolarHBondContact O-CG 3.35Å; D138-L142 PolarHBondContact O-N 3.29Å
139	L	95.8	Very high	96.1	Very high	94 Å²	94	88.8 Å²	88.8	49%	0.492	44%	0.443	S	S	.	.	H	α-helix	trans	-61.4	-40.8	171.1	-72.8	178.1	0	0	0	112.1	A135 K136 L142 A143	A135-L139 WeakPolarHBondContact O-CB 3.25Å; A135-L139 VanDerWaalsContact O-CG 3.28Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 3.37Å; K136-L139 PolarHBondContact O-N 3.45Å; L139-L142 PolarHBondContact O-N 2.87Å; L139-A143 WeakPolarHBondContact O-CB 3.33Å; L139-A143 PolarHBondContact O-N 2.97Å
140	A	96.3	Very high	96.3	Very high	53 Å²	53	91 Å²	91	44%	0.438	44%	0.443	S	S	.	.	H	α-helix	trans	-64.2	-43.5	176.2	0	0	0	0	0	111.6	K136 A137 D138 A143 I144	K136-A140 WeakPolarHBondContact O-CB 3.33Å; K136-A140 PolarHBondContact O-N 2.97Å; A137-A140 PolarHBondContact O-N 2.86Å; D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 2.9Å; A140-A143 PolarHBondContact O-N 3.24Å; A140-I144 WeakPolarHBondContact O-CG1 3.39Å; A140-I144 PolarHBondContact O-N 3.25Å
141	R	96.9	Very high	96.3	Very high	158 Å²	158	95.6 Å²	95.6	60%	0.596	46%	0.461	S	S	*	.	H	α-helix	trans	-58.7	-47.9	173.4	-74.3	170.1	179	161.1	-5.9	111.4	A137 D138 A143 I144 I145	A137-R141 WeakPolarHBondContact O-CG 3.38Å; A137-R141 PolarHBondContact O-N 2.98Å; D138-R141 PolarHBondContact O-N 3.41Å; D138-R141 IonicContact OD1-CZ 3.89Å; D138-R141 IonicContact OD1-NH1 2.86Å; D138-R141 PolarHBondContact OD1-NH1 3.31Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 2.82Å; R141-I144 PolarHBondContact O-N 2.88Å; R141-I145 WeakPolarHBondContact O-CG1 3.37Å; R141-I145 PolarHBondContact O-N 2.88Å; R141-I145 VanDerWaalsContact O-N 3.08Å
142	L	96.5	Very high	96.4	Very high	84 Å²	84	92 Å²	92	44%	0.44	45%	0.454	S	S	.	.	H	α-helix	trans	-62.2	-38.8	176.9	-70.4	175.9	0	0	0	112	D138 L139 I145 R146	D138-L142 WeakPolarHBondContact O-CG 3.35Å; D138-L142 PolarHBondContact O-N 3.29Å; L139-L142 PolarHBondContact O-N 2.87Å; L142-I145 PolarHBondContact O-N 3.13Å; L142-R146 WeakPolarHBondContact O-CG 3.46Å; L142-R146 PolarHBondContact O-N 3.14Å
143	A	97.2	Very high	96.5	Very high	42 Å²	42	93.2 Å²	93.2	35%	0.347	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-40	176	0	0	0	0	0	112.2	L139 A140 R141 R146 K147	L139-A143 WeakPolarHBondContact O-CB 3.33Å; L139-A143 PolarHBondContact O-N 2.97Å; A140-A143 PolarHBondContact O-N 3.24Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 2.82Å; A143-R146 PolarHBondContact O-N 3.38Å; A143-K147 WeakPolarHBondContact O-CG 3.31Å; A143-K147 PolarHBondContact O-N 2.9Å
144	I	97.4	Very high	96.6	Very high	95 Å²	95	93.2 Å²	93.2	49%	0.487	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-46	174.3	-67.1	163.7	0	0	0	110.5	A140 R141 R146 K147 Q148	A140-I144 WeakPolarHBondContact O-CG1 3.39Å; A140-I144 PolarHBondContact O-N 3.25Å; R141-I144 PolarHBondContact O-N 2.88Å; I144-R146 VanDerWaalsContact C-N 3.35Å; I144-R146 PolarHBondContact O-N 2.86Å; I144-K147 PolarHBondContact O-N 3.31Å; I144-Q148 HydrophobicContact CG2-CG 4.43Å; I144-Q148 WeakPolarHBondContact O-CG 3.45Å; I144-Q148 PolarHBondContact O-N 2.86Å
145	I	97.9	Very high	96.7	Very high	74 Å²	74	93.5 Å²	93.5	38%	0.379	46%	0.46	S	S	.	.	H	α-helix	trans	-62.4	-42.7	178.2	-65.8	168.2	0	0	0	111	R141 L142 Q148 R149	R141-I145 WeakPolarHBondContact O-CG1 3.37Å; R141-I145 PolarHBondContact O-N 2.88Å; R141-I145 VanDerWaalsContact O-N 3.08Å; L142-I145 PolarHBondContact O-N 3.13Å; I145-Q148 PolarHBondContact O-N 3.4Å; I145-R149 HydrophobicContact CG2-CG 4.42Å; I145-R149 WeakPolarHBondContact O-CB 3.38Å; I145-R149 VanDerWaalsContact O-CG 3.31Å; I145-R149 WeakPolarHBondContact O-CG 3.3Å; I145-R149 PolarHBondContact O-N 2.94Å
146	R	98	Very high	96.7	Very high	140 Å²	140	99.6 Å²	99.6	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-59.4	-48.2	175.7	-73.7	-178.6	-172.3	112.7	-1.6	111.3	L142 A143 I144 Q148 R149 E150	L142-R146 WeakPolarHBondContact O-CG 3.46Å; L142-R146 PolarHBondContact O-N 3.14Å; A143-R146 PolarHBondContact O-N 3.38Å; I144-R146 VanDerWaalsContact C-N 3.35Å; I144-R146 PolarHBondContact O-N 2.86Å; R146-Q148 PolarHBondContact O-N 3.46Å; R146-R149 PolarHBondContact O-N 3.21Å; R146-E150 WeakPolarHBondContact O-CG 3.42Å; R146-E150 PolarHBondContact O-N 3.5Å
147	K	97.8	Very high	96.6	Very high	132 Å²	132	99.8 Å²	99.8	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-57.9	-47.1	175.8	-74.2	-178.9	177.3	-174.4	0	112.2	A143 I144 R149 E150 E151	A143-K147 WeakPolarHBondContact O-CG 3.31Å; A143-K147 PolarHBondContact O-N 2.9Å; I144-K147 PolarHBondContact O-N 3.31Å; K147-R149 VanDerWaalsContact C-N 3.3Å; K147-R149 PolarHBondContact O-N 2.83Å; K147-E150 PolarHBondContact O-N 3.27Å; K147-E151 WeakPolarHBondContact O-CB 3.34Å; K147-E151 VanDerWaalsContact O-CG 3.3Å; K147-E151 WeakPolarHBondContact O-CG 3.48Å; K147-E151 PolarHBondContact O-N 3.37Å
148	Q	97.8	Very high	96.4	Very high	119 Å²	119	103.9 Å²	103.9	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-61.5	-38.5	177.8	-73.3	176.7	-15	0	0	112.4	I144 I145 R146 A152	I144-Q148 HydrophobicContact CG2-CG 4.43Å; I144-Q148 WeakPolarHBondContact O-CG 3.45Å; I144-Q148 PolarHBondContact O-N 2.86Å; I145-Q148 PolarHBondContact O-N 3.4Å; R146-Q148 PolarHBondContact O-N 3.46Å; Q148-A152 WeakPolarHBondContact O-CB 3.34Å; Q148-A152 PolarHBondContact O-N 2.93Å
149	R	97.8	Very high	96.2	Very high	185 Å²	185	105.7 Å²	105.7	70%	0.698	51%	0.506	S	S	*	.	H	α-helix	trans	-68	-44.3	176.1	-73.8	179.4	-179.8	-171	1	112	I145 R146 K147 A152 A153	I145-R149 HydrophobicContact CG2-CG 4.42Å; I145-R149 WeakPolarHBondContact O-CB 3.38Å; I145-R149 VanDerWaalsContact O-CG 3.31Å; I145-R149 WeakPolarHBondContact O-CG 3.3Å; I145-R149 PolarHBondContact O-N 2.94Å; R146-R149 PolarHBondContact O-N 3.21Å; K147-R149 VanDerWaalsContact C-N 3.3Å; K147-R149 PolarHBondContact O-N 2.83Å; R149-A152 PolarHBondContact O-N 3.36Å; R149-A153 WeakPolarHBondContact O-CB 3.3Å; R149-A153 PolarHBondContact O-N 2.9Å
150	E	96.9	Very high	96.1	Very high	108 Å²	108	107.6 Å²	107.6	51%	0.505	51%	0.51	S	S	.	.	H	α-helix	trans	-63.9	-44.4	177	-73	171.5	-157.1	0	0	111.6	R146 K147 A153 K154	R146-E150 WeakPolarHBondContact O-CG 3.42Å; R146-E150 PolarHBondContact O-N 3.5Å; K147-E150 PolarHBondContact O-N 3.27Å; E150-A153 PolarHBondContact O-N 3.08Å; E150-K154 WeakPolarHBondContact O-CB 3.36Å; E150-K154 VanDerWaalsContact O-CG 3.3Å; E150-K154 WeakPolarHBondContact O-CG 3.46Å; E150-K154 PolarHBondContact O-N 2.85Å
151	E	95.9	Very high	96	Very high	107 Å²	107	111.5 Å²	111.5	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175.3	-73.6	174	-167.2	0	0	111.8	K147 K154 K155	K147-E151 WeakPolarHBondContact O-CB 3.34Å; K147-E151 VanDerWaalsContact O-CG 3.3Å; K147-E151 WeakPolarHBondContact O-CG 3.48Å; K147-E151 PolarHBondContact O-N 3.37Å; E151-K154 PolarHBondContact O-N 3.33Å; E151-K155 WeakPolarHBondContact O-CB 3.33Å; E151-K155 VanDerWaalsContact O-CG 3.3Å; E151-K155 WeakPolarHBondContact O-CG 3.21Å; E151-K155 PolarHBondContact O-N 3.34Å
152	A	96.3	Very high	95.8	Very high	47 Å²	47	106.9 Å²	106.9	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-66.3	-37.5	175.3	0	0	0	0	0	112.2	Q148 R149 K156	Q148-A152 WeakPolarHBondContact O-CB 3.34Å; Q148-A152 PolarHBondContact O-N 2.93Å; R149-A152 PolarHBondContact O-N 3.36Å; A152-K156 WeakPolarHBondContact O-CB 3.44Å; A152-K156 VanDerWaalsContact O-CG 3.29Å; A152-K156 WeakPolarHBondContact O-CG 3.37Å; A152-K156 PolarHBondContact O-N 2.89Å
153	A	96.4	Very high	95.6	Very high	46 Å²	46	109.7 Å²	109.7	38%	0.38	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-47.3	174.8	0	0	0	0	0	111.1	R149 E150 K155 K156 E157	R149-A153 WeakPolarHBondContact O-CB 3.3Å; R149-A153 PolarHBondContact O-N 2.9Å; E150-A153 PolarHBondContact O-N 3.08Å; A153-K155 PolarHBondContact O-N 3.24Å; A153-K156 PolarHBondContact O-N 3.44Å; A153-E157 WeakPolarHBondContact O-CG 3.21Å; A153-E157 PolarHBondContact O-N 3.21Å
154	K	95.6	Very high	95.4	Very high	123 Å²	123	114 Å²	114	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-58.6	-48.3	175.2	-74.1	175.2	-179.6	177.6	0	112	E150 E151 K156 E157 E158	E150-K154 WeakPolarHBondContact O-CB 3.36Å; E150-K154 VanDerWaalsContact O-CG 3.3Å; E150-K154 WeakPolarHBondContact O-CG 3.46Å; E150-K154 PolarHBondContact O-N 2.85Å; E151-K154 PolarHBondContact O-N 3.33Å; K154-K156 VanDerWaalsContact C-N 3.33Å; K154-K156 PolarHBondContact O-N 2.78Å; K154-E157 PolarHBondContact O-N 3.45Å; K154-E157 VanDerWaalsContact O-N 3.14Å; K154-E158 WeakPolarHBondContact O-CG 3.36Å; K154-E158 PolarHBondContact O-N 2.82Å
155	K	95.6	Very high	95.1	Very high	126 Å²	126	112.4 Å²	112.4	55%	0.548	54%	0.536	S	S	.	.	H	α-helix	trans	-58.5	-43	175.4	-75.5	179.8	179.8	-178.7	0	112.1	E151 A153 E157 E158 E159	E151-K155 WeakPolarHBondContact O-CB 3.33Å; E151-K155 VanDerWaalsContact O-CG 3.3Å; E151-K155 WeakPolarHBondContact O-CG 3.21Å; E151-K155 PolarHBondContact O-N 3.34Å; A153-K155 PolarHBondContact O-N 3.24Å; K155-E157 PolarHBondContact O-N 3.21Å; K155-E158 PolarHBondContact O-N 3.43Å; K155-E159 WeakPolarHBondContact O-CB 3.24Å; K155-E159 WeakPolarHBondContact O-CG 3.36Å; K155-E159 PolarHBondContact O-N 3.46Å
156	K	94.8	Very high	94.8	Very high	136 Å²	136	111.8 Å²	111.8	59%	0.591	54%	0.542	S	S	*	.	H	α-helix	trans	-64.4	-38.4	175.8	-77.1	-178.5	-175.4	-175	0	112.6	A152 A153 K154 K160	A152-K156 WeakPolarHBondContact O-CB 3.44Å; A152-K156 VanDerWaalsContact O-CG 3.29Å; A152-K156 WeakPolarHBondContact O-CG 3.37Å; A152-K156 PolarHBondContact O-N 2.89Å; A153-K156 PolarHBondContact O-N 3.44Å; K154-K156 VanDerWaalsContact C-N 3.33Å; K154-K156 PolarHBondContact O-N 2.78Å; K156-K160 WeakPolarHBondContact O-CB 3.41Å; K156-K160 WeakPolarHBondContact O-CG 3.27Å; K156-K160 PolarHBondContact O-N 3.36Å
157	E	93.5	Very high	94.5	Very high	111 Å²	111	108 Å²	108	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-68.7	-41.7	176.4	-74.6	-179.1	-173.1	0	0	112.2	A153 K154 K155 K160 K161	A153-E157 WeakPolarHBondContact O-CG 3.21Å; A153-E157 PolarHBondContact O-N 3.21Å; K154-E157 PolarHBondContact O-N 3.45Å; K154-E157 VanDerWaalsContact O-N 3.14Å; K155-E157 PolarHBondContact O-N 3.21Å; E157-K160 PolarHBondContact O-N 2.99Å; E157-K161 WeakPolarHBondContact O-CB 3.45Å; E157-K161 WeakPolarHBondContact O-CG 3.36Å; E157-K161 PolarHBondContact O-N 3.49Å
158	E	93.1	Very high	94.1	Very high	128 Å²	128	104.6 Å²	104.6	60%	0.598	54%	0.537	S	S	*	.	H	α-helix	trans	-63.1	-45.3	175.2	-72.4	170.9	-174.8	0	0	111.5	K154 K155 K160 K161 A162	K154-E158 WeakPolarHBondContact O-CG 3.36Å; K154-E158 PolarHBondContact O-N 2.82Å; K155-E158 PolarHBondContact O-N 3.43Å; E158-K160 VanDerWaalsContact C-N 3.34Å; E158-K160 PolarHBondContact O-N 2.86Å; E158-K161 PolarHBondContact O-N 2.99Å; E158-A162 WeakPolarHBondContact O-CB 3.29Å; E158-A162 PolarHBondContact O-N 2.87Å
159	E	92.1	Very high	93.7	Very high	112 Å²	112	101.8 Å²	101.8	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-63.1	-39.3	175.1	-76.2	179.3	-163.7	0	0	112.4	K155 K163	K155-E159 WeakPolarHBondContact O-CB 3.24Å; K155-E159 WeakPolarHBondContact O-CG 3.36Å; K155-E159 PolarHBondContact O-N 3.46Å; E159-K163 WeakPolarHBondContact O-CB 3.35Å; E159-K163 VanDerWaalsContact O-CG 3.24Å; E159-K163 WeakPolarHBondContact O-CG 3.42Å; E159-K163 PolarHBondContact O-N 2.94Å
160	K	94	Very high	93.3	Very high	134 Å²	134	95.9 Å²	95.9	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-47.8	175	-78.7	176	179.1	-172.1	0	111.1	K156 E157 E158 A162 K163 E164	K156-K160 WeakPolarHBondContact O-CB 3.41Å; K156-K160 WeakPolarHBondContact O-CG 3.27Å; K156-K160 PolarHBondContact O-N 3.36Å; E157-K160 PolarHBondContact O-N 2.99Å; E158-K160 VanDerWaalsContact C-N 3.34Å; E158-K160 PolarHBondContact O-N 2.86Å; K160-A162 VanDerWaalsContact C-N 3.34Å; K160-A162 PolarHBondContact O-N 2.92Å; K160-K163 PolarHBondContact O-N 3.43Å; K160-E164 WeakPolarHBondContact O-CB 3.39Å; K160-E164 WeakPolarHBondContact O-CG 3.3Å; K160-E164 PolarHBondContact O-N 2.77Å
161	K	93.9	Very high	92.9	Very high	134 Å²	134	93.8 Å²	93.8	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-61.4	-40.7	176.9	-74.4	174.4	-177.8	172.3	0	112.1	E157 E158 E164 A165	E157-K161 WeakPolarHBondContact O-CB 3.45Å; E157-K161 WeakPolarHBondContact O-CG 3.36Å; E157-K161 PolarHBondContact O-N 3.49Å; E158-K161 PolarHBondContact O-N 2.99Å; K161-E164 PolarHBondContact O-N 2.98Å; K161-A165 VanDerWaalsContact O-CB 3.27Å; K161-A165 WeakPolarHBondContact O-CB 3.36Å; K161-A165 PolarHBondContact O-N 3.19Å
162	A	93.2	Very high	92.5	Very high	62 Å²	62	91.6 Å²	91.6	51%	0.512	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175.5	0	0	0	0	0	112	E158 K160 A166	E158-A162 WeakPolarHBondContact O-CB 3.29Å; E158-A162 PolarHBondContact O-N 2.87Å; K160-A162 VanDerWaalsContact C-N 3.34Å; K160-A162 PolarHBondContact O-N 2.92Å; A162-A166 VanDerWaalsContact O-CB 3.25Å; A162-A166 WeakPolarHBondContact O-CB 3.33Å; A162-A166 PolarHBondContact O-N 3.17Å
163	K	92.9	Very high	92	Very high	142 Å²	142	92.3 Å²	92.3	62%	0.617	53%	0.532	S	S	*	.	H	α-helix	trans	-66.2	-41.2	175.3	-75.4	171.3	-178.3	170.2	0	112.2	E159 K160 A166 A167	E159-K163 WeakPolarHBondContact O-CB 3.35Å; E159-K163 VanDerWaalsContact O-CG 3.24Å; E159-K163 WeakPolarHBondContact O-CG 3.42Å; E159-K163 PolarHBondContact O-N 2.94Å; K160-K163 PolarHBondContact O-N 3.43Å; K163-A166 PolarHBondContact O-N 3.26Å; K163-A167 VanDerWaalsContact O-CB 3.22Å; K163-A167 WeakPolarHBondContact O-CB 3.24Å; K163-A167 PolarHBondContact O-N 3.4Å
164	E	92.2	Very high	91.3	Very high	132 Å²	132	99.9 Å²	99.9	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-65.9	-43.6	175.9	-75.2	172.4	-168.3	0	0	111.4	K160 K161 A167 A168	K160-E164 WeakPolarHBondContact O-CB 3.39Å; K160-E164 WeakPolarHBondContact O-CG 3.3Å; K160-E164 PolarHBondContact O-N 2.77Å; K161-E164 PolarHBondContact O-N 2.98Å; E164-A167 PolarHBondContact O-N 3.45Å; E164-A168 VanDerWaalsContact O-CB 3.24Å; E164-A168 WeakPolarHBondContact O-CB 3.22Å; E164-A168 PolarHBondContact O-N 3.23Å
165	A	91.4	Very high	90.6	Very high	63 Å²	63	95.4 Å²	95.4	52%	0.521	54%	0.539	S	S	.	.	H	α-helix	trans	-63.1	-42	174.2	0	0	0	0	0	111.8	K161 A168 A169	K161-A165 VanDerWaalsContact O-CB 3.27Å; K161-A165 WeakPolarHBondContact O-CB 3.36Å; K161-A165 PolarHBondContact O-N 3.19Å; A165-A168 PolarHBondContact O-N 2.88Å; A165-A169 VanDerWaalsContact O-CB 3.25Å; A165-A169 WeakPolarHBondContact O-CB 3.24Å; A165-A169 PolarHBondContact O-N 2.86Å
166	A	90.9	Very high	89.8	Confident	60 Å²	60	94.2 Å²	94.2	50%	0.496	54%	0.542	S	S	.	.	H	α-helix	trans	-65.8	-40.9	175.2	0	0	0	0	0	111.9	A162 K163 A169 A170	A162-A166 VanDerWaalsContact O-CB 3.25Å; A162-A166 WeakPolarHBondContact O-CB 3.33Å; A162-A166 PolarHBondContact O-N 3.17Å; K163-A166 PolarHBondContact O-N 3.26Å; A166-A169 PolarHBondContact O-N 3.41Å; A166-A170 VanDerWaalsContact O-CB 3.24Å; A166-A170 WeakPolarHBondContact O-CB 3.27Å; A166-A170 PolarHBondContact O-N 3.4Å
167	A	91.5	Very high	88.9	Confident	61 Å²	61	92.9 Å²	92.9	50%	0.504	54%	0.542	S	S	.	.	H	α-helix	trans	-66.4	-41	175.7	0	0	0	0	0	111.8	K163 E164 A170 A171	K163-A167 VanDerWaalsContact O-CB 3.22Å; K163-A167 WeakPolarHBondContact O-CB 3.24Å; K163-A167 PolarHBondContact O-N 3.4Å; E164-A167 PolarHBondContact O-N 3.45Å; A167-A170 PolarHBondContact O-N 2.95Å; A167-A171 VanDerWaalsContact O-CB 3.27Å; A167-A171 WeakPolarHBondContact O-CB 3.34Å; A167-A171 PolarHBondContact O-N 3.37Å
168	A	90.6	Very high	87.9	Confident	60 Å²	60	91 Å²	91	50%	0.496	54%	0.541	S	S	.	.	H	α-helix	trans	-65.8	-43.3	175.2	0	0	0	0	0	111.6	E164 A165 A171 A172	E164-A168 VanDerWaalsContact O-CB 3.24Å; E164-A168 WeakPolarHBondContact O-CB 3.22Å; E164-A168 PolarHBondContact O-N 3.23Å; A165-A168 PolarHBondContact O-N 2.88Å; A168-A171 PolarHBondContact O-N 2.84Å; A168-A172 WeakPolarHBondContact O-CB 3.25Å; A168-A172 PolarHBondContact O-N 3.48Å
169	A	89.4	Confident	87	Confident	61 Å²	61	91.3 Å²	91.3	50%	0.504	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-42.1	174.4	0	0	0	0	0	111.8	A165 A166 A172 A173	A165-A169 VanDerWaalsContact O-CB 3.25Å; A165-A169 WeakPolarHBondContact O-CB 3.24Å; A165-A169 PolarHBondContact O-N 2.86Å; A166-A169 PolarHBondContact O-N 3.41Å; A169-A172 PolarHBondContact O-N 2.84Å; A169-A173 WeakPolarHBondContact O-CB 3.37Å; A169-A173 PolarHBondContact O-N 3.43Å
170	A	89.6	Confident	85.9	Confident	60 Å²	60	89.9 Å²	89.9	50%	0.496	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-40.1	175.6	0	0	0	0	0	112.2	A166 A167 R174	A166-A170 VanDerWaalsContact O-CB 3.24Å; A166-A170 WeakPolarHBondContact O-CB 3.27Å; A166-A170 PolarHBondContact O-N 3.4Å; A167-A170 PolarHBondContact O-N 2.95Å; A170-R174 VanDerWaalsContact O-CB 3.31Å; A170-R174 WeakPolarHBondContact O-CB 3.45Å; A170-R174 PolarHBondContact O-N 2.87Å
171	A	88.6	Confident	84.5	Confident	65 Å²	65	90.6 Å²	90.6	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-65	-43.1	174.8	0	0	0	0	0	111.8	A167 A168 R174 G175	A167-A171 VanDerWaalsContact O-CB 3.27Å; A167-A171 WeakPolarHBondContact O-CB 3.34Å; A167-A171 PolarHBondContact O-N 3.37Å; A168-A171 PolarHBondContact O-N 2.84Å; A171-R174 PolarHBondContact O-N 3.43Å; A171-G175 PolarHBondContact O-N 2.85Å
172	A	87.4	Confident	82.7	Confident	61 Å²	61	96 Å²	96	50%	0.504	58%	0.581	S	S	.	*	H	α-helix	trans	-63	-47.3	175.5	0	0	0	0	0	111.7	A168 A169 R174 G175 V176	A168-A172 WeakPolarHBondContact O-CB 3.25Å; A168-A172 PolarHBondContact O-N 3.48Å; A169-A172 PolarHBondContact O-N 2.84Å; A172-R174 VanDerWaalsContact C-N 3.32Å; A172-R174 PolarHBondContact O-N 3.44Å; A172-G175 PolarHBondContact O-N 2.8Å; A172-G175 VanDerWaalsContact O-N 3.17Å; A172-V176 WeakPolarHBondContact O-CG2 3.25Å; A172-V176 PolarHBondContact O-N 3.07Å
173	A	84.5	Confident	82.2	Confident	61 Å²	61	97.7 Å²	97.7	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-60.3	-41.2	176.7	0	0	0	0	0	112	A169 V176 N177	A169-A173 WeakPolarHBondContact O-CB 3.37Å; A169-A173 PolarHBondContact O-N 3.43Å; A173-V176 PolarHBondContact O-N 2.71Å; A173-N177 PolarHBondContact O-N 3.17Å
174	R	83.3	Confident	81.6	Confident	206 Å²	206	95.3 Å²	95.3	78%	0.777	58%	0.583	S	S	*	*	H	α-helix	trans	-65.5	-37.6	175.7	-169.1	174.3	179.2	168.6	-0.1	112.4	A170 A171 A172 S178	A170-R174 VanDerWaalsContact O-CB 3.31Å; A170-R174 WeakPolarHBondContact O-CB 3.45Å; A170-R174 PolarHBondContact O-N 2.87Å; A171-R174 PolarHBondContact O-N 3.43Å; A172-R174 VanDerWaalsContact C-N 3.32Å; A172-R174 PolarHBondContact O-N 3.44Å; R174-S178 PolarHBondContact O-N 3.15Å; R174-S178 VanDerWaalsContact O-N 3.17Å
175	G	80.1	Confident	81	Confident	28 Å²	28	93.3 Å²	93.3	29%	0.289	58%	0.581	S	S	.	*	H	α-helix	trans	-63.6	-46.5	174.6	0	0	0	0	0	112.7	A171 A172 S178 L179	A171-G175 PolarHBondContact O-N 2.85Å; A172-G175 PolarHBondContact O-N 2.8Å; A172-G175 VanDerWaalsContact O-N 3.17Å; G175-S178 PolarHBondContact O-N 2.94Å; G175-S178 PolarHBondContact O-OG 3.31Å; G175-L179 PolarHBondContact O-N 3.15Å
176	V	79.3	Confident	80.4	Confident	101 Å²	101	95.1 Å²	95.1	61%	0.612	58%	0.584	S	S	*	*	H	α-helix	trans	-63.6	-43.8	178.3	178.4	0	0	0	0	111.4	A172 A173 S178 L179 S180	A172-V176 WeakPolarHBondContact O-CG2 3.25Å; A172-V176 PolarHBondContact O-N 3.07Å; A173-V176 PolarHBondContact O-N 2.71Å; V176-S178 VanDerWaalsContact C-N 3.26Å; V176-S178 PolarHBondContact O-N 3.1Å; V176-L179 PolarHBondContact O-N 3.17Å; V176-L179 VanDerWaalsContact O-N 3.15Å; V176-S180 PolarHBondContact O-N 3.06Å; V176-S180 VanDerWaalsContact O-N 3.17Å
177	N	75.3	Confident	79.7	Confident	109 Å²	109	97.3 Å²	97.3	58%	0.583	59%	0.59	S	S	*	*	H	α-helix	trans	-62.4	-32.7	176.5	-117.4	21.6	0	0	0	112.8	A173 L179 S180 L181	A173-N177 PolarHBondContact O-N 3.17Å; N177-L179 VanDerWaalsContact C-N 3.34Å; N177-S180 PolarHBondContact O-OG 2.97Å; N177-S180 VanDerWaalsContact O-OG 3.1Å; N177-L181 WeakPolarHBondContact O-CD1 3.31Å
178	S	72.9	Confident	79	Confident	72 Å²	72	99.7 Å²	99.7	50%	0.503	60%	0.595	S	S	.	*	H	α-helix	trans	-74.5	-24.4	177.5	73.9	0	0	0	0	113.7	R174 G175 V176	R174-S178 PolarHBondContact O-N 3.15Å; R174-S178 VanDerWaalsContact O-N 3.17Å; G175-S178 PolarHBondContact O-N 2.94Å; G175-S178 PolarHBondContact O-OG 3.31Å; V176-S178 VanDerWaalsContact C-N 3.26Å; V176-S178 PolarHBondContact O-N 3.1Å
179	L	72.9	Confident	78.1	Confident	133 Å²	133	102.5 Å²	102.5	70%	0.696	60%	0.603	S	S	*	*	H	α-helix	trans	-82.2	-28.6	176.7	-81.7	156.4	0	0	0	112.4	G175 V176 N177 L181	G175-L179 PolarHBondContact O-N 3.15Å; V176-L179 PolarHBondContact O-N 3.17Å; V176-L179 VanDerWaalsContact O-N 3.15Å; N177-L179 VanDerWaalsContact C-N 3.34Å; L179-L181 VanDerWaalsContact C-N 3.32Å
180	S	69.3	Low	77.2	Confident	83 Å²	83	105.7 Å²	105.7	58%	0.58	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-5.1	178.6	63.2	0	0	0	0	114.8	V176 N177	V176-S180 PolarHBondContact O-N 3.06Å; V176-S180 VanDerWaalsContact O-N 3.17Å; N177-S180 PolarHBondContact O-OG 2.97Å; N177-S180 VanDerWaalsContact O-OG 3.1Å
181	L	64.8	Low	76.2	Confident	148 Å²	148	109.5 Å²	109.5	78%	0.775	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	8.8	-179.2	-84.6	160.1	0	0	0	113.3	N177 L179	N177-L181 WeakPolarHBondContact O-CD1 3.31Å; L179-L181 VanDerWaalsContact C-N 3.32Å
182	K	56.4	Low	75.1	Confident	247 Å²	247	113.5 Å²	113.5	100%	1.074	63%	0.627	S	S	*	*			trans	-114.6	0	172.5	-80.6	175.7	174	174.9	0	109.8

Retrieved 182 of 182 residues in 102 ms (Link to these results)

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